data_2rqk_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2rqk _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.414 HD11 ' HB2' ' A' ' 103' ' ' ASP . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -54.57 -22.68 13.92 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.684 0.278 . . . . 0.0 111.625 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.36 -45.14 88.81 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.515 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -67.95 -40.66 83.2 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.676 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.562 ' O ' ' HB2' ' A' ' 11' ' ' MET . 81.0 m-20 -51.12 -69.05 0.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.641 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -53.49 -64.23 0.89 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.295 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.56 -58.69 4.26 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.302 -172.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 5.8 m-20 -70.17 -34.69 73.3 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -171.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.562 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 29.8 mmt -68.96 -41.55 77.84 Favored 'General case' 0 C--O 1.227 -0.132 0 C-N-CA 119.691 -0.804 . . . . 0.0 109.243 176.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.05 -49.75 68.29 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -66.49 -39.56 88.8 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.298 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.487 HD21 ' HD2' ' A' ' 98' ' ' PHE . 57.4 tp -66.9 -51.46 55.07 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.877 0.37 . . . . 0.0 110.891 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.51 HD11 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -69.99 -29.48 66.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.259 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.29 -34.98 66.98 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.061 0.458 . . . . 0.0 110.169 177.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -62.19 -53.02 61.23 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.89 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -57.74 -36.14 71.67 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.987 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -61.5 -50.04 74.3 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.508 ' O ' HG13 ' A' ' 24' ' ' ILE . 31.8 ttmt -65.4 -35.24 80.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.343 -177.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -66.22 -44.93 82.42 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.867 0.365 . . . . 0.0 110.043 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -61.63 -33.5 74.05 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.894 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.27 -42.1 72.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.952 175.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 20' ' ' LYS . 71.5 mt -61.11 -36.6 73.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -70.09 -35.1 73.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.482 175.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.88 -24.63 66.1 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.26 24.36 22.14 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.458 -0.792 . . . . 0.0 114.042 174.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -159.17 156.8 29.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 117.062 0.431 . . . . 0.0 110.454 172.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.371 -178.164 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.4 mt . . . . . 0 N--CA 1.468 0.443 0 CA-C-O 121.385 0.612 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.51 ' SD ' HD11 ' A' ' 15' ' ' LEU . 55.1 mtm -138.12 145.34 41.51 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 170.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.529 ' HG2' HD23 ' A' ' 133' ' ' LEU . 64.3 mtt -128.37 134.2 48.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.886 0.374 . . . . 0.0 111.829 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.42 ' CZ ' ' HG2' ' A' ' 134' ' ' GLU . 43.7 m-85 -98.03 121.65 40.21 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 166.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 39.3 t -116.38 104.16 16.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.595 0.236 . . . . 0.0 110.777 -174.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.449 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 86.9 m -72.41 107.66 5.1 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 174.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.724 HG11 HG21 ' A' ' 80' ' ' ILE . 42.3 t -101.09 -62.92 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.718 0.294 . . . . 0.0 111.204 -173.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.7 m -92.62 -45.81 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.867 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.66 10.69 67.71 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.799 -0.921 . . . . 0.0 110.799 -169.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.503 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 30.3 t30 -126.11 129.23 24.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 123.615 0.766 . . . . 0.0 109.096 -177.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.503 ' HD2' ' OD1' ' A' ' 71' ' ' ASN . 13.8 Cg_endo -55.15 -18.15 17.02 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.549 2.833 . . . . 0.0 114.225 -176.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.402 HG21 ' HB2' ' A' ' 75' ' ' LYS . 24.4 m -58.77 93.06 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.919 0.39 . . . . 0.0 111.611 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.448 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 2.6 mp0 -50.81 -23.66 2.92 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.289 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.568 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -59.61 -41.22 89.88 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.757 -174.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.26 -53.53 55.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.679 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.502 ' HA ' HG23 ' A' ' 80' ' ' ILE . 17.5 m -62.77 -32.88 74.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.54 -60.09 4.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.316 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 42.0 mt-10 -55.71 -55.82 27.71 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.575 0.703 . . . . 0.0 110.867 -178.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.724 HG21 HG11 ' A' ' 68' ' ' VAL . 10.7 tp -65.1 -48.93 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.073 -171.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.495 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 89.8 m -63.56 -29.83 71.03 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 122.244 -0.285 . . . . 0.0 110.662 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.3 t -59.41 -46.68 88.04 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.491 HD13 HD13 ' A' ' 80' ' ' ILE . 55.6 mt -58.39 -48.48 80.48 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.092 175.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.516 ' NE1' HG13 ' A' ' 80' ' ' ILE . 28.7 m0 -59.27 -39.45 82.93 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.098 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.5 mt-30 -64.68 -58.06 7.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.47 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -53.42 -22.26 15.38 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-N 115.71 -0.677 . . . . 0.0 113.91 176.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -88.39 -61.72 1.65 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 117.453 0.627 . . . . 0.0 111.306 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.58 -47.51 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.808 -173.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.401 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 71.3 m-85 -78.69 1.12 24.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.276 -176.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 48.8 t30 -89.34 -37.6 14.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 177.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.44 2.36 48.03 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.637 176.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.4 t30 60.87 89.32 0.08 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.268 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -114.93 140.44 49.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.531 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.66 66.67 1.08 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 110.408 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.9 m -134.71 163.51 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.832 -177.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -139.96 148.83 42.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 173.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.505 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -133.76 137.58 45.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.523 0.202 . . . . 0.0 110.591 -173.531 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.487 ' HD2' HD21 ' A' ' 14' ' ' LEU . 22.9 m-85 -124.77 136.28 53.72 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.3 tt -109.04 89.95 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.463 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.3 p -132.07 125.37 54.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.254 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.515 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 70.91 100.99 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.126 -174.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.448 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 3.0 m -56.61 -14.88 3.56 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -173.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.414 ' HB2' HD11 ' A' ' 3' ' ' ILE . 19.7 t70 -57.57 -51.36 69.78 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -134.36 132.39 39.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.614 -174.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -96.21 136.95 35.99 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 168.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.635 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.9 tt -105.62 136.95 37.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.131 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . 0.433 ' CZ ' ' HE3' ' A' ' 84' ' ' TRP . 25.3 m-85 -132.09 116.98 17.73 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.022 -176.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.635 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.1 mpp? -100.45 121.03 40.88 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.435 HD11 ' N ' ' A' ' 109' ' ' LEU . 4.9 mp -104.31 119.74 39.64 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.455 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 19.0 mmm-85 -82.36 -16.17 50.15 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -126.72 126.35 43.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.613 174.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.73 10.53 59.04 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 121.137 -0.554 . . . . 0.0 113.502 -175.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.1 m -63.72 -50.53 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.247 0.524 . . . . 0.0 110.319 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -91.93 24.59 3.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.681 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.28 -53.95 52.43 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.087 0.47 . . . . 0.0 111.313 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -71.71 -17.08 62.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.824 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -74.91 -49.96 18.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.241 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.591 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 5.1 tt -62.97 -44.91 99.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -55.15 -45.43 75.68 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.478 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.47 -42.95 93.21 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.351 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.01 -39.27 89.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.623 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 33.5 mt -68.51 -38.12 80.64 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.175 -178.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 18.8 m -84.28 -16.88 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.24 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.1 t -75.53 1.57 13.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.399 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -87.71 160.54 18.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.875 0.369 . . . . 0.0 111.53 -173.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -52.48 -66.8 0.32 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.427 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -71.94 -21.37 61.62 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.894 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.8 m 68.68 134.14 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.167 0.587 . . . . 0.0 111.581 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.436 ' HB3' ' HB3' ' A' ' 122' ' ' LEU . . . -100.65 147.56 25.84 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.423 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.449 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 38.7 mt-10 -99.83 117.72 34.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.113 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 29.9 t -110.01 134.15 53.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.384 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 24.1 p -137.72 145.73 42.88 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.529 HD23 ' HG2' ' A' ' 64' ' ' MET . 79.1 mt -86.51 158.9 19.45 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.636 0.255 . . . . 0.0 110.654 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.42 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER . . . . . 0 CA--C 1.535 0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.93 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.771 HG12 ' HB3' ' A' ' 6' ' ' TYR . 13.6 tt . . . . . 0 CA--C 1.542 0.651 0 CA-C-O 122.028 0.918 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.507 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 72.0 ttt-85 -63.75 -24.11 67.63 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.006 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.21 -42.55 99.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.362 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.771 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -57.94 -47.06 84.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.374 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.532 ' O ' ' HB2' ' A' ' 11' ' ' MET . 22.2 m-80 -47.52 -70.63 0.09 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.311 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.56 -61.95 2.13 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.996 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -57.24 -68.94 0.18 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.466 -174.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 4.5 m-20 -61.3 -48.69 80.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.257 -0.402 . . . . 0.0 112.07 -173.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.621 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 7.5 mmt -59.67 -46.38 89.22 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.273 -175.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.22 80.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.006 0.431 . . . . 0.0 111.251 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 86.8 mtt180 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.255 -174.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.457 HD13 ' N ' ' A' ' 15' ' ' LEU . 4.4 pp -89.25 -29.57 19.13 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.369 175.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.1 OUTLIER -63.71 -30.94 71.98 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 175.469 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -48.16 -42.06 28.54 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.914 177.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -62.1 -52.54 63.45 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.403 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.505 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 48.0 m95 -62.35 -39.4 92.98 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.376 -176.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.69 -48.22 80.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.654 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.3 tttt -62.11 -48.0 82.13 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.032 -178.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -44.93 86.93 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.132 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -57.6 -45.14 85.66 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.073 0.463 . . . . 0.0 110.04 176.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -62.2 -41.52 98.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.954 177.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 20' ' ' LYS . 91.1 mt -60.59 -40.86 85.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.196 0.522 . . . . 0.0 109.999 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -67.19 -31.61 72.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.813 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.33 -10.65 17.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.324 0.583 . . . . 0.0 110.198 172.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.93 33.02 7.57 Favored Glycine 0 CA--C 1.518 0.227 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.991 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -159.46 147.23 17.27 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 171.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.8 mm? . . . . . 0 C--O 1.235 0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.013 -175.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.606 HD11 HD23 ' A' ' 133' ' ' LEU . 44.2 tp . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.809 ' HE2' ' HG3' ' A' ' 108' ' ' MET . 79.8 mtp -135.08 135.11 40.98 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 166.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.517 ' SD ' HD13 ' A' ' 109' ' ' LEU . 86.9 mtp -115.84 119.38 35.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.845 0.355 . . . . 0.0 111.397 -171.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.546 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 49.6 m-85 -95.16 123.18 38.52 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.433 HG21 HD12 ' A' ' 122' ' ' LEU . 43.2 t -124.04 109.06 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 117.794 0.27 . . . . 0.0 110.939 -173.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.464 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 28.3 m -74.0 98.49 3.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.608 HG13 HG22 ' A' ' 80' ' ' ILE . 11.4 t -87.63 -58.42 3.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.296 -171.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.597 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 34.7 t -89.92 -58.87 2.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.993 -174.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 88.41 -10.76 70.27 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.512 HD22 HG22 ' A' ' 73' ' ' THR . 11.4 t30 -122.98 132.62 24.27 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.938 0.495 . . . . 0.0 109.7 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 49.4 Cg_exo -56.99 -16.17 19.76 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.139 3.226 . . . . 0.0 115.639 -172.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.512 HG22 HD22 ' A' ' 71' ' ' ASN . 18.8 p -52.26 110.68 0.52 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.467 0.576 . . . . 0.0 112.16 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 35.8 mt-10 -55.15 -23.95 23.99 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.715 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.403 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 5.2 mtpm? -42.39 -62.45 0.96 Allowed 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.006 176.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -56.67 -55.46 33.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.195 -172.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.496 HG22 ' HA ' ' A' ' 102' ' ' SER . 11.5 t -63.6 -46.18 86.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.694 -173.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -61.05 -49.35 77.72 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.886 0.375 . . . . 0.0 110.182 -177.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -62.62 -52.79 61.97 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.475 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.608 HG22 HG13 ' A' ' 68' ' ' VAL . 10.9 tp -67.16 -41.73 87.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.228 -174.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.9 m -66.53 -31.04 71.5 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.673 0.273 . . . . 0.0 110.536 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -63.64 -46.52 85.32 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.8 mt -59.66 -37.5 78.91 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.35 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.524 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 48.6 m0 -64.4 -44.35 91.56 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.484 177.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.51 -59.53 4.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.57 -62.16 4.2 Favored Glycine 0 CA--C 1.522 0.477 0 CA-C-N 115.806 -0.633 . . . . 0.0 113.139 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.1 m -58.84 -57.34 13.47 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.36 -46.69 89.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.929 0.395 . . . . 0.0 111.458 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -72.35 -27.84 62.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.125 -177.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -75.7 -28.19 58.53 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 110.064 177.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 3.63 51.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.287 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.3 t30 62.76 75.94 0.38 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.672 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.408 ' C ' ' H ' ' A' ' 95' ' ' VAL . 3.8 m-85 -107.67 122.17 46.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.086 169.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -81.24 26.49 0.45 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.227 0.537 . . . . 0.0 110.617 -176.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.408 ' H ' ' C ' ' A' ' 93' ' ' TYR . 11.1 m -92.05 157.44 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.906 -173.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -112.85 154.97 25.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.95 138.15 24.05 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -122.11 151.5 40.85 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.867 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -121.14 90.2 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.636 0.731 . . . . 0.0 110.697 -175.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.9 p -128.82 129.64 68.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 174.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.407 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 80.67 101.32 0.32 Allowed Glycine 0 C--O 1.226 -0.378 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -170.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.496 ' HA ' HG22 ' A' ' 77' ' ' THR . 15.3 m -62.55 -9.11 7.67 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -169.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.597 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 16.1 p-10 -96.42 -18.98 19.52 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 122.113 -0.367 . . . . 0.0 111.335 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.484 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 49.9 ttt180 -137.88 132.27 32.24 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.983 -172.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.22 153.51 22.04 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.407 HG23 ' HE2' ' A' ' 108' ' ' MET . 11.3 tt -124.93 136.27 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 120.844 0.354 . . . . 0.0 111.269 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . 0.409 ' HB2' ' HB2' ' A' ' 64' ' ' MET . 13.4 m-85 -117.96 139.02 51.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.751 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.809 ' HG3' ' HE2' ' A' ' 63' ' ' MET . 1.5 mpt? -109.96 115.92 30.67 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.604 178.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.533 HD12 HD21 ' A' ' 62' ' ' LEU . 15.4 mt -126.23 103.4 7.66 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.495 0.497 . . . . 0.0 111.502 -174.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mtp-105 -99.26 5.61 46.57 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 122.076 0.941 . . . . 0.0 108.502 165.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -146.85 124.09 11.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.026 -1.443 . . . . 0.0 107.674 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.63 57.17 0.25 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 119.805 -1.188 . . . . 0.0 113.808 -173.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.4 t -66.36 -25.97 67.05 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -96.79 24.02 6.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.373 177.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.32 -49.94 72.86 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.204 0.526 . . . . 0.0 111.321 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . 0.514 ' HH2' HD12 ' A' ' 133' ' ' LEU . 0.6 OUTLIER -76.62 -26.88 55.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.762 -179.208 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.06 -48.73 75.1 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 120.886 0.374 . . . . 0.0 110.297 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.605 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 15.0 tt -67.33 -39.02 81.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 177.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -55.13 -46.6 75.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.457 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.505 ' HA ' HG22 ' A' ' 123' ' ' VAL . 37.5 m-20 -61.95 -41.37 97.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.471 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -59.66 -38.44 81.46 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.099 0.476 . . . . 0.0 110.399 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 70.9 mt -69.82 -47.81 61.39 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.505 HG22 ' HA ' ' A' ' 120' ' ' ASP . 24.9 m -73.28 -18.72 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.718 0.294 . . . . 0.0 111.476 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 24.7 t -71.53 0.91 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.498 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.524 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 45.8 mt-30 -76.87 162.85 27.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.74 0.781 . . . . 0.0 112.715 -174.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.65 8.79 1.3 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.345 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.42 ' H ' ' C ' ' A' ' 125' ' ' GLN . 80.9 mtt-85 -121.14 -18.26 7.5 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 122.373 0.269 . . . . 0.0 110.882 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 52.9 t 57.59 71.75 0.56 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.357 0.599 . . . . 0.0 109.984 -172.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.52 130.21 39.6 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.028 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.464 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 42.7 mt-10 -81.26 114.04 19.79 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.252 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.3 t -95.53 128.08 47.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.5 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 33.8 p -133.08 145.28 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.606 HD23 HD11 ' A' ' 62' ' ' LEU . 60.7 mt -102.13 168.87 9.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 110.978 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.546 ' HA ' ' HE2' ' A' ' 65' ' ' PHE . 36.1 tt0 . . . . . 0 C--O 1.234 0.289 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.141 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.473 HD11 ' HA2' ' A' ' 101' ' ' GLY . 12.8 tt . . . . . 0 CA--C 1.537 0.467 0 CA-C-O 121.579 0.704 . . . . 0.0 109.988 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -57.96 -31.61 67.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.009 -176.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.45 -50.34 71.97 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.976 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.02 -47.17 86.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.993 176.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.581 ' O ' ' HB2' ' A' ' 11' ' ' MET . 91.7 m-20 -52.34 -74.93 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.961 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -51.65 -66.34 0.4 Allowed 'General case' 0 C--O 1.24 0.595 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -57.34 8.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.885 -169.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -76.26 -37.76 57.15 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.111 -168.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.64 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 11.1 mmt -67.79 -40.86 83.88 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 120.156 -0.618 . . . . 0.0 109.728 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.9 -52.28 66.14 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 121.212 0.53 . . . . 0.0 110.158 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.42 -32.37 73.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.858 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.7 tp -77.38 -52.52 9.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.819 0.343 . . . . 0.0 110.801 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 11' ' ' MET . 3.5 mm? -77.05 -10.23 59.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.995 -177.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -47.98 -53.78 15.0 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.996 175.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.18 -37.73 88.53 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.254 -177.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -61.22 -42.17 98.13 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.028 0.442 . . . . 0.0 110.764 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -69.52 -41.24 76.29 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.501 ' O ' HG13 ' A' ' 24' ' ' ILE . 59.1 tttp -54.15 -50.36 67.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.093 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.2 -54.39 47.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.01 178.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.95 -41.71 64.76 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.176 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -65.93 -44.97 83.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.644 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.4 mt -61.98 -34.69 64.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 120.856 0.36 . . . . 0.0 110.39 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -69.13 -38.74 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.308 177.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.49 -21.32 66.25 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.369 0.604 . . . . 0.0 109.658 170.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.98 17.78 46.22 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.304 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -113.8 109.14 18.07 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 176.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.444 HD12 HG12 ' A' ' 24' ' ' ILE . 3.8 mm? . . . . . 0 C--N 1.329 -0.298 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 175.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.676 HD23 ' HE2' ' A' ' 64' ' ' MET . 1.5 tm? . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 121.378 0.609 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.508 ' HE2' ' HG3' ' A' ' 134' ' ' GLU . 8.8 ptm -147.19 113.58 5.94 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.225 174.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.676 ' HE2' HD23 ' A' ' 62' ' ' LEU . 62.5 mtt -117.42 141.29 48.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.815 -170.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.47 ' HE2' ' HG2' ' A' ' 134' ' ' GLU . 51.9 m-85 -107.03 122.08 45.75 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 168.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 t -110.62 102.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 110.933 -174.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.708 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 37.1 m -77.15 100.34 5.72 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 172.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.452 HG11 HG22 ' A' ' 80' ' ' ILE . 50.4 t -80.34 -63.64 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.153 -171.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.531 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 38.7 t -93.24 -55.39 3.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.127 0.489 . . . . 0.0 112.233 -172.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.583 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 90.86 -10.27 75.39 Favored Glycine 0 N--CA 1.451 -0.329 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 -167.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.519 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 34.6 t30 -107.79 126.61 29.46 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 176.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.553 ' O ' ' HB2' ' A' ' 102' ' ' SER . 19.0 Cg_endo -56.62 -16.45 19.12 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.6 2.867 . . . . 0.0 114.42 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.638 HG23 ' HG3' ' A' ' 75' ' ' LYS . 2.1 m -61.66 95.61 0.05 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.291 0.567 . . . . 0.0 110.468 -177.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -44.94 -31.01 1.12 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.571 1.148 . . . . 0.0 113.918 -172.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.638 ' HG3' HG23 ' A' ' 73' ' ' THR . 0.0 OUTLIER -51.76 -34.61 40.2 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -175.598 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.608 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 5.6 mm-40 -58.23 -55.66 32.17 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.02 0.438 . . . . 0.0 111.023 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.6 m -65.21 -34.73 79.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.923 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.62 -51.65 68.48 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.722 0.296 . . . . 0.0 110.341 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 50.3 mt-10 -55.79 -54.11 48.47 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.33 0.586 . . . . 0.0 110.079 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.488 HD11 HD11 ' A' ' 83' ' ' LEU . 2.6 tp -62.15 -42.36 94.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.146 -172.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 72.6 m -64.67 -39.2 93.27 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.629 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.2 m -62.66 -40.28 96.56 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 120.838 0.351 . . . . 0.0 110.339 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 HD11 ' A' ' 80' ' ' ILE . 86.6 mt -60.89 -50.09 74.81 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.647 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.9 m0 -60.61 -31.7 70.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.036 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.57 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 35.3 tt0 -62.75 -63.36 1.24 Allowed 'General case' 0 C--O 1.235 0.327 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 173.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.49 -13.68 24.22 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.634 -0.712 . . . . 0.0 114.025 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -96.55 -71.36 0.68 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.376 0.588 . . . . 0.0 111.743 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.555 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 9.4 mp -56.42 -54.96 39.48 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.342 -174.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.57 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 91.8 m-85 -72.02 -14.32 61.85 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.358 -173.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -78.62 -32.7 47.58 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.46 11.74 22.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.672 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 72.65 25.7 2.56 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.359 0.664 . . . . 0.0 112.638 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.555 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 27.7 m-85 -81.99 81.77 7.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.64 82.49 3.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.239 0.542 . . . . 0.0 109.922 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.809 HG11 HD22 ' A' ' 109' ' ' LEU . 4.3 m -109.14 165.56 5.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.365 -177.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.445 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -101.5 136.54 41.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 174.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.612 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.33 142.22 23.83 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -172.805 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -127.27 127.74 44.86 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.6 tt -87.4 88.0 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 122.071 0.939 . . . . 0.0 109.125 173.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.78 134.58 38.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.119 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.473 ' HA2' HD11 ' A' ' 3' ' ' ILE . . . 100.4 104.7 2.67 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.553 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 11.1 p -38.23 -51.92 1.47 Allowed 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -173.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.583 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 10.1 p-10 -102.11 8.16 40.83 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.708 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 54.4 mtt180 -137.04 140.8 42.31 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.58 143.85 46.5 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.641 173.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.649 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.7 tt -112.34 139.56 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.741 0.305 . . . . 0.0 111.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -128.77 139.85 52.0 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.781 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.649 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.3 mpp? -135.14 143.19 46.4 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.049 0.452 . . . . 0.0 110.517 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.809 HD22 HG11 ' A' ' 95' ' ' VAL . 12.4 mt -138.44 151.98 47.92 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.366 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -85.35 -33.02 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.589 176.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -112.73 152.9 28.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.163 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -118.34 27.39 7.33 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 121.273 -0.489 . . . . 0.0 112.474 -178.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -66.02 -69.25 0.31 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.019 0.438 . . . . 0.0 110.693 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.02 25.71 1.1 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.329 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.76 92.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.824 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -77.52 -31.29 53.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.362 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -67.45 -50.84 57.44 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.215 177.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 7.6 tt -62.72 -37.9 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.344 -0.389 . . . . 0.0 109.985 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.565 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 12.2 tmtt? -56.48 -51.64 67.69 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.293 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.486 ' HA ' HG23 ' A' ' 123' ' ' VAL . 64.9 m-20 -62.15 -33.37 74.37 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.668 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -67.58 -42.79 81.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 94.5 mt -61.08 -41.65 97.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.486 HG23 ' HA ' ' A' ' 120' ' ' ASP . 20.6 m -79.06 -15.91 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.515 0.197 . . . . 0.0 111.246 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.5 t -64.87 2.17 0.76 Allowed 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.647 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -84.87 98.84 10.55 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.349 0.595 . . . . 0.0 110.174 -176.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -45.97 -51.24 13.73 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.467 -1.242 . . . . 0.0 113.582 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 30.9 mtm180 -55.79 -44.65 77.97 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.71 0.29 . . . . 0.0 111.482 -174.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.531 ' SG ' ' HA ' ' A' ' 69' ' ' SER . 21.5 p 177.07 136.0 0.06 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.779 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.511 ' HB3' ' HB2' ' A' ' 125' ' ' GLN . . . -170.93 116.98 0.46 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.75 0.309 . . . . 0.0 111.171 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -137.03 127.61 26.89 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 10.8 p -123.9 143.97 35.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 0.0 110.773 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 53.6 m -131.53 144.98 51.52 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 177.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.448 HD22 ' HG2' ' A' ' 64' ' ' MET . 64.1 mt -93.58 145.5 24.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.508 ' HG3' ' HE2' ' A' ' 63' ' ' MET . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.603 HG23 ' HB3' ' A' ' 103' ' ' ASP . 12.1 tt . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 121.61 0.719 . . . . 0.0 110.657 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 60.7 mtt85 -109.58 -37.13 5.78 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.499 -175.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -56.31 -43.58 79.06 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.736 -178.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.445 ' HE1' HG11 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -55.21 -47.11 75.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.441 176.731 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.605 ' O ' ' HB2' ' A' ' 11' ' ' MET . 44.1 m-80 -60.88 -64.54 0.92 Allowed 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -50.36 -69.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.683 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.464 ' HB2' ' NH1' ' A' ' 13' ' ' ARG . . . -59.38 -64.4 0.96 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.042 -174.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.73 -46.49 65.81 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.863 -167.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.623 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 22.3 mmt -70.54 -38.51 74.22 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.938 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.32 -47.12 77.66 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.417 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.464 ' NH1' ' HB2' ' A' ' 9' ' ' ALA . 80.3 mtt180 -70.3 -26.79 63.95 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.885 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.6 tp -82.77 -52.28 6.9 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.907 176.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 4.1 mm? -73.1 -17.25 61.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.986 -174.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.5 OUTLIER -57.47 -32.97 67.5 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.102 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.96 -45.76 84.39 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.806 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -63.29 -41.21 98.96 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.912 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 46.5 mt-10 -63.02 -43.13 99.59 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.394 0.616 . . . . 0.0 109.381 176.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 24' ' ' ILE . 26.4 ttpt -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.12 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -59.07 -44.93 91.92 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.319 0.58 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.5 -37.24 86.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.32 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.33 -37.53 80.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.945 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 20' ' ' LYS . 85.8 mt -62.17 -38.53 81.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 174.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.87 -36.34 82.97 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.898 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -63.02 -15.07 55.17 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.738 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.99 24.77 26.4 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.682 177.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -134.7 132.0 38.33 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.574 -179.482 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 C--O 1.235 0.302 0 CA-C-O 121.208 0.528 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 21.4 ptm -132.03 110.23 10.58 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.666 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 56.8 mtt -114.73 122.15 45.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.721 -169.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -88.38 117.83 27.57 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 168.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.501 HG23 HD12 ' A' ' 122' ' ' LEU . 39.5 t -114.43 104.75 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.588 0.232 . . . . 0.0 110.954 -173.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.716 HG23 ' HB2' ' A' ' 130' ' ' GLU . 1.6 t -84.96 122.37 29.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -85.35 -61.58 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.302 -174.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 30.9 t -92.88 -36.38 12.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.145 0.498 . . . . 0.0 111.127 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.94 7.52 77.61 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -168.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.457 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 7.7 t30 -126.63 139.98 36.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 114.66 -0.77 . . . . 0.0 109.802 -176.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -47.51 -16.23 0.41 Allowed 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.632 3.555 . . . . 0.0 116.586 -174.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.457 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 5.5 p -76.73 160.28 29.46 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.501 1.046 . . . . 0.0 110.869 -169.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.576 ' HG2' ' HG3' ' A' ' 78' ' ' GLU . 37.5 tt0 -104.08 -25.38 12.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.646 -166.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.667 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.58 -52.74 53.75 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.678 -171.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.407 ' CD ' ' HG1' ' A' ' 73' ' ' THR . 1.8 pm0 -45.37 -58.89 2.99 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.283 175.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.44 ' HA ' HG22 ' A' ' 80' ' ' ILE . 35.5 m -67.13 -35.97 80.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.856 -174.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.576 ' HG3' ' HG2' ' A' ' 74' ' ' GLU . 49.1 mt-10 -56.05 -60.17 3.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.09 176.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.422 ' O ' HD12 ' A' ' 83' ' ' LEU . 44.0 mt-10 -59.08 -54.02 51.82 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.899 -175.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.808 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.9 tp -62.36 -42.76 96.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.938 -174.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 91.7 m -64.0 -33.18 75.15 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.457 0.17 . . . . 0.0 111.063 176.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.1 m -63.04 -39.07 93.65 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 110.294 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 79' ' ' GLU . 10.4 mp -67.75 -48.28 66.86 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.539 174.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.672 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 43.7 m0 -55.87 -55.94 26.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.968 -179.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -57.33 -54.81 42.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.61 -29.16 3.93 Favored Glycine 0 C--N 1.333 0.393 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.273 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.6 m -91.79 -57.1 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 117.527 0.664 . . . . 0.0 111.284 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.88 -48.62 79.3 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.667 -174.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -74.31 -22.49 59.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.979 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -73.62 -29.41 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.15 0.5 51.51 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.128 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 66.43 36.59 5.06 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.193 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -81.47 119.75 24.13 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -84.75 49.94 1.81 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.245 0.545 . . . . 0.0 111.199 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.99 150.21 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -102.49 144.98 30.23 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.404 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -146.42 137.92 24.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.147 -177.117 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -127.45 123.14 35.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 175.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -93.74 88.12 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.997 0.903 . . . . 0.0 109.337 173.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.445 HG11 ' HE1' ' A' ' 6' ' ' TYR . 7.0 p -131.53 143.39 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.093 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.2 85.74 0.14 Allowed Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.9 m -30.21 -44.27 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -167.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.603 ' HB3' HG23 ' A' ' 3' ' ' ILE . 13.2 t70 -69.18 -32.81 72.38 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -172.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.46 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 93.0 mtt180 -122.46 134.17 54.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.296 0.57 . . . . 0.0 112.323 -171.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -102.65 132.68 48.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 170.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.533 HD12 ' SD ' ' A' ' 11' ' ' MET . 9.3 tt -104.65 129.68 56.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.041 0.448 . . . . 0.0 111.197 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -115.2 132.38 56.63 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.613 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -131.27 136.52 48.25 Favored 'General case' 0 C--O 1.244 0.798 0 CA-C-O 121.366 0.603 . . . . 0.0 110.993 177.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.472 HD23 HD11 ' A' ' 118' ' ' ILE . 4.6 mp -123.11 156.13 35.59 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.871 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -105.09 5.72 32.65 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -135.35 151.75 50.8 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.493 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -127.58 41.53 1.58 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.054 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.8 m -93.6 -65.53 0.99 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.055 0.455 . . . . 0.0 110.113 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.414 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 41.4 p90 -91.0 27.6 1.79 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.021 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.61 -48.1 73.4 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.74 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -30.88 69.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.202 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.414 ' HB3' ' O ' ' A' ' 114' ' ' TYR . 5.1 tp10 -52.91 -49.71 65.39 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 172.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.602 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 25.1 mt -64.46 -45.41 95.86 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.126 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -58.17 7.32 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.317 0.58 . . . . 0.0 110.072 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.493 ' O ' ' HB2' ' A' ' 124' ' ' SER . 11.2 m-20 -61.38 -36.85 81.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.791 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -63.36 -47.16 83.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.738 0.304 . . . . 0.0 110.381 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.5 mt -57.81 -45.9 85.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.815 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.504 HG11 ' O ' ' A' ' 129' ' ' ALA . 13.1 m -84.97 -6.75 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -177.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 23.2 t -68.65 0.99 3.54 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.808 ' HG2' HD11 ' A' ' 80' ' ' ILE . 2.9 mp0 -96.04 155.7 16.65 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.602 -0.686 . . . . 0.0 110.633 -174.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -51.59 -51.68 53.56 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.873 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -67.18 -10.12 47.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.483 179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 63.4 m 66.08 -156.62 0.26 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.906 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' HG11 ' A' ' 123' ' ' VAL . . . 173.23 126.77 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.716 ' HB2' HG23 ' A' ' 67' ' ' THR . 46.0 mt-10 -96.97 113.66 25.21 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.339 0.59 . . . . 0.0 110.331 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.9 t -98.99 135.94 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.282 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.4 m -127.1 112.75 15.54 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.666 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.6 mp -89.95 128.03 36.15 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 . . . . . 0 C--N 1.325 -0.46 0 CA-C-O 120.866 0.365 . . . . 0.0 110.109 176.982 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.4 tt . . . . . 0 C--O 1.236 0.374 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -52.25 -36.41 52.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.304 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.6 -49.9 75.8 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.008 0.433 . . . . 0.0 110.4 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.4 -48.09 76.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.662 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.08 -62.01 1.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.635 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -57.71 -56.91 15.77 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.281 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.93 -61.48 2.58 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.586 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.91 -54.87 41.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.162 -174.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.572 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 6.2 mmt -58.01 -52.39 65.72 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-O 120.599 0.238 . . . . 0.0 110.904 -176.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.55 -50.18 74.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.019 0.438 . . . . 0.0 111.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -77.41 -12.11 59.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.142 -0.481 . . . . 0.0 112.095 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.2 tp -79.96 -52.15 8.2 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.387 0.613 . . . . 0.0 109.572 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.46 HD21 ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.7 -15.31 62.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.72 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.49 -43.41 45.26 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.572 0.701 . . . . 0.0 109.724 171.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.76 -45.65 93.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.454 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.438 ' CZ3' ' HG3' ' A' ' 108' ' ' MET . 28.4 m95 -62.26 -37.43 85.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -60.49 -43.5 96.94 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.053 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.9 tttt -61.43 -50.76 71.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.458 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.11 -46.71 79.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.792 0.329 . . . . 0.0 111.469 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -57.44 -48.69 78.48 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.369 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 28.9 t70 -71.62 -28.88 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 20' ' ' LYS . 50.4 mt -64.42 -42.51 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -69.98 -26.95 64.33 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.03 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.408 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 8.4 tp10 -60.44 -18.32 50.3 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.642 0.734 . . . . 0.0 109.264 169.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.14 35.26 6.38 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.84 172.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -156.48 141.84 17.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.0 mp . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.492 179.654 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.676 HD12 ' HE2' ' A' ' 64' ' ' MET . 2.0 tm? . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 121.238 0.542 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.746 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 28.9 mtp -138.74 132.17 30.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.676 ' HE2' HD12 ' A' ' 62' ' ' LEU . 63.4 mtt -116.88 125.21 51.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.225 0.536 . . . . 0.0 112.147 -170.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.574 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 72.2 m-85 -95.17 121.63 37.01 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 168.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.479 HG21 HD12 ' A' ' 122' ' ' LEU . 40.6 t -117.02 105.59 18.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.755 0.312 . . . . 0.0 110.614 -174.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.2 m -79.37 98.42 6.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.479 HG12 HG22 ' A' ' 80' ' ' ILE . 25.2 t -79.64 -60.33 2.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.727 -172.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.447 ' OG ' ' HB3' ' A' ' 71' ' ' ASN . 39.9 t -92.62 -57.03 2.8 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.015 -173.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.701 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 82.12 11.52 82.29 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 -167.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.538 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 8.4 t30 -125.99 136.07 27.96 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 123.15 0.58 . . . . 0.0 109.709 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -59.99 -16.89 41.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.886 3.057 . . . . 0.0 116.382 -168.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.538 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 2.7 p -69.65 172.18 7.85 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.27 0.941 . . . . 0.0 112.144 -173.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.91 -22.62 14.29 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.41 -167.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 10.8 mptt -60.65 -51.89 67.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.601 -170.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.528 ' HG2' ' H ' ' A' ' 77' ' ' THR . 1.6 pm0 -47.57 -62.58 1.37 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.721 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.528 ' H ' ' HG2' ' A' ' 76' ' ' GLU . 14.2 t -60.96 -43.9 98.06 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.48 0.181 . . . . 0.0 110.904 -174.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -57.4 -60.87 3.0 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.165 0.507 . . . . 0.0 110.881 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.491 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 37.6 mt-10 -67.73 -37.85 82.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.701 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.479 HG22 HG12 ' A' ' 68' ' ' VAL . 9.8 tp -70.09 -39.76 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.444 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.5 m -64.87 -38.03 89.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.608 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.4 p -67.47 -34.86 78.03 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.701 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 92.5 mt -64.6 -48.85 73.38 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.965 0.412 . . . . 0.0 110.074 174.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 m0 -58.18 -39.9 80.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.803 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -57.15 -58.82 6.54 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.57 -28.07 36.15 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 115.439 -0.8 . . . . 0.0 113.804 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.7 m -85.15 -69.3 0.66 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 117.395 0.597 . . . . 0.0 111.805 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.5 mp -59.95 -35.09 74.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -172.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -85.67 -2.58 58.33 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -103.85 -26.27 12.75 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 171.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.85 -11.25 59.94 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.308 0.575 . . . . 0.0 109.461 168.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 66.56 78.74 0.25 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.647 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -117.13 170.65 8.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.667 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -125.86 98.22 5.44 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.411 HG12 ' CD2' ' A' ' 109' ' ' LEU . 30.9 m -139.02 153.7 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.756 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.449 ' HB3' ' SD ' ' A' ' 108' ' ' MET . 6.6 tp60 -101.56 145.57 28.85 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 169.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.638 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -148.79 132.84 17.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.618 -169.771 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -129.96 132.88 46.47 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.141 175.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.496 HD12 HG23 ' A' ' 77' ' ' THR . 8.6 tt -91.31 89.03 2.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.704 0.764 . . . . 0.0 109.677 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.4 125.62 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.056 -178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 101.0 104.6 2.72 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -167.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.438 ' O ' ' HB ' ' A' ' 77' ' ' THR . 16.0 m -47.93 -34.03 8.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.575 0.584 . . . . 0.0 112.575 -175.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.701 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 7.1 p-10 -103.22 -4.19 24.69 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -135.67 136.34 40.85 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.919 0.39 . . . . 0.0 111.789 -164.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.2 154.68 30.71 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.003 175.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.7 tt -123.41 139.05 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.412 178.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -131.41 154.32 48.77 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.114 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 96' ' ' GLN . 0.8 OUTLIER -148.38 135.32 20.07 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.357 0.599 . . . . 0.0 111.821 176.265 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.433 ' HB2' HD11 ' A' ' 62' ' ' LEU . 13.2 mt -108.93 109.33 20.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.589 174.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.72 -27.06 31.42 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 175.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -147.38 111.61 5.18 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.925 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.52 129.32 1.34 Allowed Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.756 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.3 m -95.25 -19.75 19.76 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 111.043 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -75.64 35.9 0.13 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.962 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.0 -56.44 21.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.877 -177.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . 0.401 ' HA ' ' HB3' ' A' ' 119' ' ' LYS . 0.7 OUTLIER -73.96 -14.42 61.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.522 -176.684 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -75.55 -52.47 10.55 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.499 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.9 tt -62.38 -39.35 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.496 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 51.9 tttm -54.71 -51.67 64.86 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.511 174.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.49 -43.86 76.0 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.561 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -66.74 -39.76 88.06 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 98.7 mt -65.5 -39.97 92.5 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.046 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.451 ' C ' ' H ' ' A' ' 125' ' ' GLN . 30.0 m -89.41 -2.66 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 120.821 0.343 . . . . 0.0 111.081 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.2 t -61.99 2.16 0.24 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' A' ' 123' ' ' VAL . 72.6 mt-30 -87.3 104.25 16.23 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.429 0.633 . . . . 0.0 110.347 -174.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -48.31 -44.81 34.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.328 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -69.23 -44.82 71.23 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.437 ' SG ' ' N ' ' A' ' 129' ' ' ALA . 23.5 t -166.75 -152.95 0.14 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.631 -171.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.437 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . 84.25 109.23 0.06 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.048 0.939 . . . . 0.0 111.921 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -124.28 141.43 52.07 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.422 175.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 14.8 p -118.83 149.71 21.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.023 0.44 . . . . 0.0 111.474 -174.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.3 m -143.18 146.83 34.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 86.4 mt -86.85 162.32 17.83 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.838 0.352 . . . . 0.0 111.222 -175.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.746 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 1.6 tm-20 . . . . . 0 C--O 1.234 0.286 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.893 177.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 50.6 mm . . . . . 0 CA--C 1.531 0.239 0 CA-C-O 120.792 0.329 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.3 mtm105 -61.15 -50.16 74.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.506 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.98 -49.76 74.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.336 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -58.78 -46.92 86.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.15 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.433 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.2 m-80 -53.19 -71.56 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.173 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -53.6 -61.86 2.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.197 -176.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.4 -63.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.663 -172.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.58 -43.53 89.46 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.795 -170.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.523 ' HE1' HG11 ' A' ' 100' ' ' VAL . 35.3 mtp -72.88 -32.5 65.43 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.055 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.32 88.99 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 172.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 94.7 mtt180 -69.23 -18.85 63.93 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.881 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 66.2 tp -79.52 -52.84 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 110.168 175.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.406 ' CD1' ' HE2' ' A' ' 63' ' ' MET . 3.9 mm? -71.95 -9.37 58.26 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.781 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -48.25 -40.48 24.76 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.64 0.733 . . . . 0.0 109.159 168.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.43 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 51.2 tp60 -61.49 -50.06 74.25 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.442 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.42 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 13.8 m95 -59.73 -35.13 73.93 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.485 -177.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -60.95 -46.19 91.71 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -59.08 -44.17 91.88 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.976 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -59.32 -55.09 39.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.718 0.294 . . . . 0.0 110.632 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.2 -37.72 78.13 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.92 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.08 -50.43 73.3 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.59 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.497 HG12 HD12 ' A' ' 29' ' ' LEU . 77.2 mt -58.57 -39.46 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-O 121.134 0.493 . . . . 0.0 110.248 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.7 -35.15 79.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -78.41 -1.21 32.43 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.13 27.46 37.02 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.38 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -126.75 109.94 12.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.617 0.246 . . . . 0.0 110.392 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.497 HD12 HG12 ' A' ' 24' ' ' ILE . 3.5 mm? . . . . . 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.7 tt . . . . . 0 C--O 1.238 0.474 0 CA-C-O 121.841 0.829 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.749 ' HE3' ' HG3' ' A' ' 108' ' ' MET . 67.4 mtp -141.02 144.33 34.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.631 172.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.2 mtt -118.42 122.43 42.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.86 0.362 . . . . 0.0 111.385 -176.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.499 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 52.2 m-85 -98.47 95.38 7.28 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.9 t -87.83 146.43 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 122.244 -0.285 . . . . 0.0 110.327 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.457 ' HB ' ' NH2' ' A' ' 104' ' ' ARG . 7.2 t -125.26 110.37 13.96 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 174.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.51 HG12 HG23 ' A' ' 80' ' ' ILE . 21.4 t -98.44 -60.94 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.355 -169.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -83.34 -50.08 8.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.862 -170.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.8 20.34 74.2 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -168.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -126.35 136.97 29.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 114.743 -0.729 . . . . 0.0 109.125 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -64.05 -15.79 51.26 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.32 2.68 . . . . 0.0 114.693 -172.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.596 HG23 ' HD3' ' A' ' 75' ' ' LYS . 17.1 m -75.76 119.97 20.5 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.555 0.693 . . . . 0.0 111.26 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -55.58 -23.62 28.18 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.528 0.731 . . . . 0.0 111.557 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.596 ' HD3' HG23 ' A' ' 73' ' ' THR . 11.0 mptt -62.2 -62.83 1.49 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.705 -169.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.433 ' OE1' ' HB ' ' A' ' 73' ' ' THR . 13.8 pm0 -65.95 -37.15 85.27 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.543 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.503 HG23 HD11 ' A' ' 99' ' ' ILE . 12.2 t -68.3 -38.79 82.0 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.638 0.256 . . . . 0.0 110.312 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.83 -46.62 89.84 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.447 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 45.7 mt-10 -56.18 -54.24 47.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.134 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.586 HD13 HD12 ' A' ' 83' ' ' LEU . 11.1 tp -63.19 -43.14 98.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-O 120.946 0.403 . . . . 0.0 111.006 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.8 m -66.69 -30.7 71.02 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.065 0.46 . . . . 0.0 110.21 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.7 t -70.68 -33.9 71.4 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.699 177.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.586 HD12 HD13 ' A' ' 80' ' ' ILE . 88.0 mt -63.52 -45.16 91.91 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.254 0.549 . . . . 0.0 109.705 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.646 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.1 m0 -60.85 -44.66 96.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.948 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -57.84 -38.64 76.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.234 0.54 . . . . 0.0 109.982 172.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.18 -31.35 77.28 Favored Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.737 -178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.4 m -95.99 -60.36 1.65 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.77 -48.05 80.77 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -69.95 -32.7 71.08 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.739 0.304 . . . . 0.0 110.892 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -67.66 -28.22 67.52 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.237 0.541 . . . . 0.0 109.705 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.85 8.73 11.6 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.366 175.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 68.13 30.17 5.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.094 174.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -89.45 108.36 19.6 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 173.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -80.47 62.74 4.68 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.328 0.585 . . . . 0.0 110.623 178.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.5 m -90.45 167.75 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.113 176.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.732 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.8 tp60 -110.17 143.13 40.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.447 173.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.86 135.13 35.89 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.726 0.298 . . . . 0.0 110.539 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -131.02 153.45 49.24 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.503 HD11 HG23 ' A' ' 77' ' ' THR . 9.4 tt -130.71 90.04 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.68 0.752 . . . . 0.0 110.745 -179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.523 HG11 ' HE1' ' A' ' 11' ' ' MET . 6.2 p -130.57 128.24 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 173.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.9 104.01 2.67 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -167.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -46.68 -25.63 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 67' ' ' THR . 12.1 p-10 -100.67 -27.73 13.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.319 0.58 . . . . 0.0 110.209 178.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.471 ' HG2' ' HE3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -84.62 121.57 27.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.764 -171.322 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -116.42 132.42 56.68 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 13.0 tt -124.38 132.25 71.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-O 121.083 0.468 . . . . 0.0 111.44 -173.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -120.74 128.75 53.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.355 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.749 ' HG3' ' HE3' ' A' ' 63' ' ' MET . 1.8 mpt? -99.16 122.33 42.22 Favored 'General case' 0 C--O 1.247 0.971 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.347 177.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.433 HD23 ' N ' ' A' ' 109' ' ' LEU . 2.4 mm? -117.64 121.66 41.48 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 123.839 0.712 . . . . 0.0 109.264 174.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.7 mmm-85 -67.89 -49.11 63.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -128.27 110.99 12.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.769 172.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -89.86 47.01 3.15 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.616 -175.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.2 m -59.56 -39.69 84.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.269 0.557 . . . . 0.0 110.481 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 22.0 p90 -98.34 23.32 8.53 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.154 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.54 97.39 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.509 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -67.71 -34.05 76.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.353 -176.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -59.55 -43.58 93.5 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.102 0.477 . . . . 0.0 109.91 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.546 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -65.39 -42.22 93.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.481 176.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -53.72 -52.06 61.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.225 0.536 . . . . 0.0 110.182 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.439 ' HA ' HG21 ' A' ' 123' ' ' VAL . 1.7 m-20 -62.04 -38.1 87.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.635 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -61.86 -53.68 52.55 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.722 0.296 . . . . 0.0 110.464 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 76.0 mt -50.65 -47.69 58.49 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.419 177.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.439 HG21 ' HA ' ' A' ' 120' ' ' ASP . 19.8 m -80.22 -13.34 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.583 0.23 . . . . 0.0 111.412 -177.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.1 t -73.9 -0.78 17.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.957 0.408 . . . . 0.0 110.558 175.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.646 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 21.3 mt-30 -84.13 165.24 18.63 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -78.79 -47.1 17.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.776 -167.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -86.89 -20.68 27.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.094 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 57.6 m 67.37 175.36 0.26 Allowed 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.433 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -161.24 156.46 24.18 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.96 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -99.74 157.1 16.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.246 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.69 151.66 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.139 0.495 . . . . 0.0 111.221 -174.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.499 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 59.8 m -124.87 134.49 52.68 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 88.9 mt -96.5 142.75 28.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.329 -175.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.963 178.656 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.2 tt . . . . . 0 CA--C 1.537 0.467 0 CA-C-O 122.246 1.022 . . . . 0.0 108.408 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.448 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 18.4 ttp180 -63.06 -37.28 86.57 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.382 -1.281 . . . . 0.0 111.651 -175.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.19 -46.62 85.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.19 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.548 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.9 OUTLIER -54.32 -47.67 72.23 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 173.342 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.517 ' O ' ' HB2' ' A' ' 11' ' ' MET . 0.8 OUTLIER -50.63 -76.18 0.02 OUTLIER 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.735 -177.808 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -61.3 -61.94 2.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.14 -176.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.44 -50.64 70.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.949 -169.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.548 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 1.3 m-20 -78.48 -43.57 26.74 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.523 -172.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.651 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 8.9 mmt -63.12 -43.05 99.49 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.833 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.526 ' O ' ' HG3' ' A' ' 16' ' ' GLU . . . -64.51 -53.91 40.72 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.902 0.382 . . . . 0.0 110.327 177.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.1 ttp-105 -52.33 -38.75 59.42 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.946 -175.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.6 tp -84.88 -49.16 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.334 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.508 HD23 ' O ' ' A' ' 11' ' ' MET . 4.5 mm? -68.11 -21.43 64.95 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -172.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 29.8 mt-10 -55.64 -25.71 40.58 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.914 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.451 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 46.4 tt0 -63.08 -49.74 73.31 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 176.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -64.31 -35.29 80.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.161 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.98 -53.19 61.01 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.517 ' O ' HG13 ' A' ' 24' ' ' ILE . 20.1 ttpp -51.67 -43.11 62.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.791 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -62.21 -52.79 62.36 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.546 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -69.55 -28.24 65.83 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.4 -177.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -65.16 -45.78 83.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.1 0.476 . . . . 0.0 110.397 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 20' ' ' LYS . 68.6 mt -60.75 -43.91 96.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.341 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -66.14 -36.25 82.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -63.75 -26.25 68.56 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.413 0.625 . . . . 0.0 109.763 175.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.97 40.84 4.5 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.518 176.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -147.04 110.3 4.82 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 173.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.236 0.363 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.527 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 pp . . . . . 0 C--O 1.243 0.753 0 CA-C-O 122.402 1.096 . . . . 0.0 113.553 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 23.8 ptp -125.69 132.61 52.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 113.709 -1.587 . . . . 0.0 107.99 174.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.454 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 82.8 mtp -108.29 116.91 32.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 -174.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.43 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 56.5 m-85 -89.16 125.51 35.08 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.488 HG13 HD21 ' A' ' 122' ' ' LEU . 22.1 t -115.83 98.3 6.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.74 ' HB ' ' HB3' ' A' ' 130' ' ' GLU . 4.9 m -74.41 94.92 2.63 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 176.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 p -102.11 -47.1 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.096 -169.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 m -91.26 -49.23 6.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.883 0.373 . . . . 0.0 111.569 -172.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 66.99 10.96 57.56 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -170.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.413 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 33.2 t30 -127.2 125.72 24.11 Favored Pre-proline 0 CA--C 1.533 0.306 0 C-N-CA 123.229 0.612 . . . . 0.0 109.565 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 25.4 Cg_exo -61.94 -18.3 60.48 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.282 2.655 . . . . 0.0 113.503 -177.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.435 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 37.7 m -55.44 104.15 0.12 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.699 0.4 . . . . 0.0 111.073 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.485 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 42.1 mt-10 -50.05 -25.93 3.88 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.3 OUTLIER -58.49 -37.61 75.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.809 -177.113 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -57.74 -64.79 0.78 Allowed 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.639 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.456 ' HA ' HG21 ' A' ' 80' ' ' ILE . 12.6 t -62.3 -36.13 81.17 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.648 -177.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -53.47 -59.7 4.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.988 0.423 . . . . 0.0 110.922 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.78 -45.74 74.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.373 -175.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.456 HG21 ' HA ' ' A' ' 77' ' ' THR . 10.8 tp -66.92 -42.02 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.164 -175.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 67.8 m -69.86 -33.15 71.87 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.638 0.256 . . . . 0.0 110.447 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.6 t -59.33 -47.53 85.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.114 0.483 . . . . 0.0 109.719 175.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.8 mt -59.78 -48.19 82.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.053 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.545 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 44.1 m0 -58.69 -32.74 69.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.032 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.613 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 29.6 tt0 -66.1 -62.77 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.403 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -57.69 -18.12 30.19 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.791 -0.64 . . . . 0.0 114.143 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.3 m -95.88 -65.28 0.98 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 117.498 0.649 . . . . 0.0 111.574 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.33 -52.31 54.76 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.83 0.348 . . . . 0.0 111.34 -173.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.613 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 98.1 m-85 -72.27 -9.13 58.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 0.0 111.156 -176.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 39.2 t30 -72.81 -26.81 61.64 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.51 14.32 17.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.759 177.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 60.11 77.35 0.32 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.037 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -107.33 119.14 38.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.548 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -78.09 69.35 4.29 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.691 0.757 . . . . 0.0 109.768 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.528 HG23 HD11 ' A' ' 109' ' ' LEU . 57.7 t -126.02 136.79 59.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.586 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -101.6 115.46 30.57 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.502 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -107.49 131.93 53.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.243 -175.21 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.514 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.5 m-30 -110.55 131.09 55.35 Favored 'General case' 0 C--O 1.247 0.962 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.4 tt -111.38 89.69 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.991 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.44 144.39 17.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.68 82.51 0.23 Allowed Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.966 -1.254 . . . . 0.0 109.966 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.485 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 12.6 m -50.13 -23.6 2.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -168.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -61.0 -25.07 66.62 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.678 0.275 . . . . 0.0 110.828 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -145.49 159.62 42.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.612 0.72 . . . . 0.0 112.398 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -122.64 139.54 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.857 -1.065 . . . . 0.0 108.326 168.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.514 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 5.1 tt -110.12 126.3 67.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.588 -177.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . 0.457 ' HB3' HG11 ' A' ' 95' ' ' VAL . 96.8 m-85 -112.25 112.1 23.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.185 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.506 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 68.5 mtm -90.93 122.43 33.61 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.528 HD11 HG23 ' A' ' 95' ' ' VAL . 4.0 mm? -87.61 103.92 16.02 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 123.513 0.508 . . . . 0.0 110.718 -175.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.6 -28.95 56.34 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 172.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -135.2 116.27 14.27 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.677 -1.147 . . . . 0.0 108.644 172.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -103.92 16.52 50.56 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.223 -0.513 . . . . 0.0 114.038 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -60.5 -20.39 59.98 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 117.207 0.504 . . . . 0.0 111.373 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -120.0 24.73 10.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.071 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.87 87.65 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.435 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -79.92 -27.01 39.92 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.02 -178.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.15 -50.47 70.3 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.0 tt -64.68 -41.47 92.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.129 176.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.442 ' HG3' HG11 ' A' ' 131' ' ' VAL . 86.7 tttt -54.83 -53.01 60.78 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.816 0.341 . . . . 0.0 110.943 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.498 ' HA ' HG23 ' A' ' 123' ' ' VAL . 20.0 m-20 -61.08 -39.14 88.79 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.584 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.432 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 89.7 t80 -60.31 -39.96 88.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.924 0.392 . . . . 0.0 109.988 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.2 mt -66.55 -41.01 89.33 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.375 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.498 HG23 ' HA ' ' A' ' 120' ' ' ASP . 18.7 m -75.61 -19.08 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.728 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 54.1 m -82.33 0.05 43.46 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.329 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.545 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 15.1 mm100 -73.77 162.87 28.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.897 0.38 . . . . 0.0 111.036 -177.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -54.31 -64.4 0.84 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.373 -174.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 127' ' ' ARG . 40.7 mtt180 -65.2 -7.6 13.54 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 44.0 t 57.25 79.24 0.2 Allowed 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -172.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.41 140.77 57.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 -171.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.74 ' HB3' ' HB ' ' A' ' 67' ' ' THR . 39.8 tt0 -79.12 118.39 21.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.727 177.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.442 HG11 ' HG3' ' A' ' 119' ' ' LYS . 48.1 t -101.55 130.14 51.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.47 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.43 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 20.7 p -135.86 129.33 32.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.454 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.1 mp -112.43 127.23 55.97 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 . . . . . 0 C--N 1.327 -0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.972 177.364 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.416 HG12 ' HD2' ' A' ' 6' ' ' TYR . 15.3 tt . . . . . 0 CA--C 1.548 0.903 0 CA-C-O 122.268 1.032 . . . . 0.0 108.592 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -71.62 -42.1 68.05 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -163.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -51.74 -50.13 61.2 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.886 0.374 . . . . 0.0 110.981 -172.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.465 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -63.29 -41.32 98.96 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.95 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.63 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 14.4 m-80 -55.7 -72.14 0.08 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.05 -63.06 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.344 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.13 -66.29 0.56 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.648 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -69.5 -43.85 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.928 -169.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.63 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 1.3 mmt -70.68 -45.27 65.35 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.778 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.25 97.49 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.511 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -81.24 -12.84 59.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.531 -177.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.511 ' HG ' HD21 ' A' ' 15' ' ' LEU . 5.5 tp -82.17 -54.33 5.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.026 0.441 . . . . 0.0 110.089 169.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.528 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 4.4 mm? -65.59 -25.55 67.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.92 -177.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -51.78 -42.18 62.21 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.325 0.584 . . . . 0.0 109.967 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.55 -48.82 79.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.273 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.491 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 43.6 m95 -58.32 -40.05 81.02 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.877 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.528 ' HG2' ' O ' ' A' ' 15' ' ' LEU . 41.7 mm-40 -61.36 -49.56 76.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.787 178.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.481 ' O ' HG13 ' A' ' 24' ' ' ILE . 78.9 tttt -60.61 -38.45 84.73 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.937 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -43.1 98.26 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -63.06 -39.82 95.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.303 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -61.43 -45.43 94.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.863 0.364 . . . . 0.0 110.496 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.4 mt -61.35 -36.4 72.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.442 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.1 -45.01 74.92 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -66.9 -17.91 65.13 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.988 176.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.84 48.83 3.29 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.441 173.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -150.29 128.92 12.3 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.402 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.532 0.272 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.157 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.508 HD13 ' HE1' ' A' ' 64' ' ' MET . 0.5 OUTLIER . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 110.467 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.659 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 15.6 ptm -144.47 112.4 6.3 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.928 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.508 ' HE1' HD13 ' A' ' 62' ' ' LEU . 65.7 mtt -114.22 122.82 47.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.412 -175.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -93.93 111.14 22.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 171.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.411 HG21 HG13 ' A' ' 131' ' ' VAL . 30.0 t -112.14 112.29 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 122.241 -0.287 . . . . 0.0 110.96 -172.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.597 HG21 ' HB2' ' A' ' 130' ' ' GLU . 3.8 t -87.56 107.07 18.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.3 m -101.79 -40.04 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.037 -171.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 36.7 t -86.9 -55.54 3.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.482 -172.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.647 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 78.38 -4.92 57.78 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.525 -171.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -125.87 132.78 24.42 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 123.323 0.649 . . . . 0.0 109.416 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.63 ' O ' ' HB3' ' A' ' 102' ' ' SER . 35.1 Cg_endo -60.13 -16.37 39.45 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.375 2.717 . . . . 0.0 114.389 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.414 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 23.7 m -60.96 100.17 0.11 Allowed 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.933 -0.48 . . . . 0.0 110.116 173.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -57.11 -23.21 45.43 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.404 -174.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.499 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -55.46 -34.73 64.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.361 -173.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.402 ' O ' HD13 ' A' ' 80' ' ' ILE . 34.9 mm-40 -59.26 -50.9 72.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.314 0.578 . . . . 0.0 109.484 176.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.8 m -67.83 -29.73 68.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.815 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.36 -49.86 72.2 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -59.76 -48.37 81.96 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 110.059 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.444 HG13 ' NE2' ' A' ' 125' ' ' GLN . 1.5 mp -53.72 -54.06 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.062 178.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.0 m -62.82 -35.45 79.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.076 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.6 t -63.7 -57.34 10.3 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.925 0.393 . . . . 0.0 110.635 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.86 -44.23 97.24 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.811 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.508 ' CZ3' HD21 ' A' ' 122' ' ' LEU . 45.3 m0 -63.89 -38.73 92.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.532 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -59.91 -60.98 2.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.17 -52.17 13.25 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.968 177.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.1 m -59.3 -54.78 42.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.777 0.323 . . . . 0.0 111.686 -176.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.447 HD11 ' O ' ' A' ' 84' ' ' TRP . 9.7 mp -69.28 -29.15 66.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.405 -175.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -75.66 -30.61 59.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.6 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.35 -30.99 70.94 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.71 4.57 36.07 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.384 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.8 t30 60.91 66.19 0.93 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.146 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -115.57 101.29 8.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.57 173.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.74 73.66 1.54 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.501 0.667 . . . . 0.0 110.621 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.2 m -87.98 157.21 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.528 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.491 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.9 tp60 -110.94 100.93 9.55 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.569 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.3 OUTLIER -109.8 138.81 45.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.575 -174.008 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.402 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 68.3 m-85 -134.98 128.52 32.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.26 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.5 tt -87.87 87.57 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-O 121.926 0.87 . . . . 0.0 108.918 169.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 p -132.35 121.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.465 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 100.8 102.74 2.56 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 -163.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.63 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 41.0 m -37.67 -50.6 1.19 Allowed 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -171.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.647 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.5 p-10 -100.62 7.44 43.98 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -173.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.5 mtt180 -128.5 139.59 52.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.227 0.537 . . . . 0.0 111.809 -173.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.08 128.16 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.05 171.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.402 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 9.8 tt -98.31 123.14 50.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 121.173 0.511 . . . . 0.0 110.641 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -112.59 108.13 17.1 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.848 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.451 ' SD ' HD11 ' A' ' 15' ' ' LEU . 70.5 mtm -108.34 130.67 55.19 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.093 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.424 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 65.8 mt -117.88 122.5 43.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.119 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.439 ' HG3' HH11 ' A' ' 110' ' ' ARG . 0.0 OUTLIER -68.49 -49.86 56.56 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.021 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -113.12 111.67 22.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.977 -1.011 . . . . 0.0 108.706 172.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -108.54 43.86 1.62 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.817 -171.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 m -61.55 -31.6 71.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 110.586 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -101.99 21.31 14.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.014 -176.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.92 -54.94 40.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.581 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -31.56 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.984 -174.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -66.02 -39.55 90.32 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.078 0.466 . . . . 0.0 109.755 177.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.557 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.2 mt -60.76 -52.77 57.68 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.195 173.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.22 -48.39 54.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.94 0.4 . . . . 0.0 110.388 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -59.83 -42.82 94.39 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.995 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.57 -50.16 68.37 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.057 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 13.4 mt -57.68 -43.31 84.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.135 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -74.7 -26.9 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 120.995 -0.282 . . . . 0.0 111.572 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -78.62 2.66 18.63 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.255 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.444 ' NE2' HG13 ' A' ' 80' ' ' ILE . 1.1 tm0? -74.13 161.27 30.17 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.776 0.322 . . . . 0.0 111.024 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.74 -66.24 0.58 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.696 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.424 ' N ' ' OE1' ' A' ' 125' ' ' GLN . 36.1 mtm180 -69.99 -3.02 14.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.282 176.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.507 ' SG ' ' N ' ' A' ' 129' ' ' ALA . 42.1 t 73.77 176.58 0.25 Allowed 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.212 0.605 . . . . 0.0 111.48 174.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.507 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -169.8 135.24 1.43 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.711 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.597 ' HB2' HG21 ' A' ' 67' ' ' THR . 39.2 mm-40 -102.23 113.64 27.1 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 173.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.411 HG13 HG21 ' A' ' 66' ' ' VAL . 46.1 t -94.16 120.13 43.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 -177.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.6 m -107.79 130.06 55.0 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.507 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.9 mp -106.37 114.54 28.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.659 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 27.0 mm-40 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.8 tt . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 122.122 0.963 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.546 ' HA ' ' HB2' ' A' ' 7' ' ' ASN . 12.1 mtp180 -70.69 -17.54 62.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.732 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -54.55 -52.34 62.36 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.501 ' OH ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -66.27 -44.51 83.38 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.17 178.667 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.546 ' HB2' ' HA ' ' A' ' 4' ' ' ARG . 25.3 m-80 -51.3 -78.58 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.239 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.96 -59.88 3.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.788 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.58 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -67.86 -60.6 2.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -171.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.615 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 12.8 t70 -69.66 -39.13 77.25 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.974 -169.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.523 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 2.0 mmt -64.42 -45.5 87.31 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.65 -42.58 71.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.871 0.367 . . . . 0.0 110.218 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.615 ' HD2' ' HA ' ' A' ' 10' ' ' ASP . 81.9 mtt180 -54.09 -62.38 1.69 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.083 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.491 HD11 HD21 ' A' ' 15' ' ' LEU . 3.9 pp -80.33 -18.41 49.24 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -171.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.491 HD21 HD11 ' A' ' 14' ' ' LEU . 3.5 mm? -79.34 -30.49 42.73 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.132 -0.355 . . . . 0.0 110.945 175.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -50.09 -39.02 41.33 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.265 0.555 . . . . 0.0 110.513 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -61.28 -38.93 88.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.238 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.491 ' CZ2' ' HG2' ' A' ' 108' ' ' MET . 61.7 m95 -66.15 -42.48 88.98 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.211 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -62.59 -46.68 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.551 ' O ' HG13 ' A' ' 24' ' ' ILE . 22.9 tttm -51.58 -54.33 28.81 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.729 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.8 -38.88 76.79 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -173.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -60.0 -45.63 92.13 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.396 0.617 . . . . 0.0 109.377 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 36.9 m-20 -66.54 -28.56 68.64 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.4 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 20' ' ' LYS . 60.1 mt -70.83 -42.85 77.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.255 176.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -73.32 -16.97 61.35 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.047 0.451 . . . . 0.0 109.972 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.5 tp10 -58.89 -15.15 11.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.443 0.64 . . . . 0.0 109.639 168.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.45 28.14 11.99 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.238 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -160.51 158.88 30.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.443 ' N ' HD21 ' A' ' 29' ' ' LEU . 3.1 mm? . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.941 -175.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 62.9 mt . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 21.8 ptp -138.53 114.34 9.93 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.772 171.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 86.0 mtp -108.88 117.81 35.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.535 -173.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.504 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 1.3 m-85 -97.42 121.31 39.17 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.0 t -117.11 105.51 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.787 0.327 . . . . 0.0 110.492 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 10.1 m -78.29 105.84 9.8 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.761 HG13 HG22 ' A' ' 80' ' ' ILE . 41.3 t -88.97 -61.77 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.482 -170.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.505 ' HB2' ' HG3' ' A' ' 76' ' ' GLU . 47.4 t -92.59 -46.46 7.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.332 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.96 2.97 87.74 Favored Glycine 0 CA--C 1.519 0.287 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -168.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.543 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 9.3 t30 -121.81 132.0 24.32 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.423 ' O ' ' HB2' ' A' ' 102' ' ' SER . 46.5 Cg_endo -63.43 -15.46 48.58 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.59 2.86 . . . . 0.0 116.058 -165.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.543 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 0.9 OUTLIER -71.7 133.01 45.35 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.184 0.902 . . . . 0.0 112.437 -169.941 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -50.33 -42.14 52.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.386 -1.279 . . . . 0.0 113.589 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.81 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.0 mptp? -49.15 -60.84 2.45 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -165.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.505 ' HG3' ' HB2' ' A' ' 69' ' ' SER . 2.1 pm0 -50.81 -60.39 3.11 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.053 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.638 ' HA ' HG21 ' A' ' 80' ' ' ILE . 45.5 m -71.08 -28.36 64.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.841 -174.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.38 -52.24 66.45 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 43.6 mt-10 -64.97 -48.0 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.243 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.761 HG22 HG13 ' A' ' 68' ' ' VAL . 10.6 tp -62.31 -41.96 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.74 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 96.5 m -67.26 -32.95 74.32 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.862 0.363 . . . . 0.0 110.433 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.2 t -62.47 -40.31 96.22 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.625 HD12 HD11 ' A' ' 80' ' ' ILE . 77.0 mt -62.58 -44.75 95.53 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.497 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 49.0 m0 -57.25 -37.36 72.2 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.601 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.48 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 0.9 OUTLIER -62.3 -61.49 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.732 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.51 -19.84 43.03 Favored Glycine 0 CA--C 1.523 0.542 0 CA-C-N 115.683 -0.689 . . . . 0.0 114.266 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.499 ' HB2' HD13 ' A' ' 88' ' ' LEU . 18.1 m -96.38 -69.33 0.76 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.081 0.44 . . . . 0.0 111.193 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 87' ' ' SER . 4.7 mp -78.51 -57.46 3.76 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.952 0.406 . . . . 0.0 111.259 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.48 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 94.9 m-85 -68.85 -11.34 60.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.251 -173.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -71.98 -27.04 62.5 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.771 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.96 3.67 22.14 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.038 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 62.99 66.33 0.75 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.625 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -84.46 160.71 20.5 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.154 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -95.37 15.88 18.32 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.094 0.473 . . . . 0.0 110.93 -177.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.3 t -88.17 151.55 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.96 176.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -132.39 140.86 48.65 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.05 159.03 42.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.482 -0.192 . . . . 0.0 110.482 -173.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -138.53 154.84 48.78 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.695 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.3 tt -115.5 89.82 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.011 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -118.42 132.73 67.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 173.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 61.3 82.89 0.07 OUTLIER Glycine 0 C--N 1.332 0.34 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 -166.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 16.9 m -43.69 -42.15 5.17 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -166.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -52.46 -21.7 3.98 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.501 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 33.0 ttt180 -133.12 133.2 42.61 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 110.741 -175.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.88 134.39 52.13 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.2 tt -108.55 132.74 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.72 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -106.09 123.78 48.55 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.425 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.491 ' HG2' ' CZ2' ' A' ' 18' ' ' TRP . 2.1 mpt? -96.11 114.0 25.66 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 171.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 109' ' ' LEU . 2.2 mm? -101.34 103.81 14.78 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.471 -178.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.8 mmm-85 -76.24 -50.34 14.71 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 166.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -104.37 110.65 22.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.518 172.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -110.68 11.76 30.15 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.358 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.1 t -58.54 -40.19 82.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.103 0.478 . . . . 0.0 110.423 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -97.85 21.35 10.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.536 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.33 -37.65 88.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.057 0.456 . . . . 0.0 110.404 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -22.76 62.36 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.646 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -73.08 -37.42 66.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.439 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 mt -63.09 -47.82 90.74 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.26 173.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -57.46 -41.84 81.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -58.31 -44.93 88.83 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.343 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . 0.41 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 73.1 t80 -64.02 -50.35 68.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.249 177.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 96.4 mt -49.64 -43.91 47.16 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.941 177.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.647 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 28.7 m -84.83 -14.35 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-O 120.971 0.415 . . . . 0.0 111.033 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -80.27 1.1 29.91 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.121 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.497 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 40.9 mt-30 -71.84 165.09 24.83 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.965 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -54.21 -64.99 0.65 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.635 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -101.05 -15.46 17.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.052 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.647 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 48.8 t 70.88 170.11 0.32 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.068 0.547 . . . . 0.0 111.154 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.453 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -135.91 171.19 14.82 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.734 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.565 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 44.3 mt-10 -84.34 115.04 22.29 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.597 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -87.83 132.9 31.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.504 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 9.2 m -131.51 138.17 48.84 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 35.1 mt -122.2 111.91 17.53 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.576 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 28.3 mm-40 . . . . . 0 C--N 1.328 -0.347 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.4 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.684 HG12 ' HB3' ' A' ' 6' ' ' TYR . 9.5 tt . . . . . 0 N--CA 1.475 0.815 0 CA-C-O 121.48 0.657 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -56.01 -34.2 65.59 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.387 -177.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.53 -48.01 69.44 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.556 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.684 ' HB3' HG12 ' A' ' 3' ' ' ILE . 2.8 t80 -57.55 -47.11 82.94 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -52.78 -68.11 0.2 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.731 -177.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -54.63 -67.65 0.25 Allowed 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.343 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.55 -58.67 7.3 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.728 -171.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -66.4 -56.74 9.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.749 -172.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.667 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 10.5 mmt -59.63 -49.99 75.63 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.793 0.33 . . . . 0.0 110.663 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.13 -51.8 49.54 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.994 0.426 . . . . 0.0 111.291 -175.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.5 mtt180 -82.47 -6.99 59.64 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.993 -170.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -91.7 -52.54 4.71 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -72.65 -15.59 61.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.289 -176.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -48.4 -41.03 27.81 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.859 0.838 . . . . 0.0 109.51 170.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -68.19 -40.23 82.28 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.963 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 3.3 m95 -60.49 -41.44 94.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.86 0.362 . . . . 0.0 110.776 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.69 -47.01 88.17 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.554 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.6 tmtt? -52.3 -44.57 65.1 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.443 177.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -67.18 -45.96 75.4 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.641 0.257 . . . . 0.0 111.393 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -58.32 -41.53 84.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.826 0.346 . . . . 0.0 110.678 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 22.0 m-20 -67.76 -36.1 79.9 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.782 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.8 mt -58.39 -43.42 86.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 175.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -37.59 87.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.428 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 37.5 tt0 -56.55 -22.39 32.99 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.91 174.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.73 31.78 14.7 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.27 -0.49 . . . . 0.0 112.34 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -141.22 129.3 22.05 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--O 1.235 0.335 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.53 -179.971 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 109' ' ' LEU . 2.2 tm? . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.509 0.671 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.638 ' SD ' ' HG3' ' A' ' 108' ' ' MET . 50.5 mtm -133.38 136.35 45.24 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 166.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 60.4 mtt -118.53 117.65 29.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.196 -174.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.63 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 16.6 m-85 -90.06 101.61 14.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 172.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.6 t -92.56 106.7 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.639 0.257 . . . . 0.0 111.264 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.572 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 87.7 m -83.06 108.28 16.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.65 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 42.7 t -100.97 -60.75 2.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.978 0.418 . . . . 0.0 111.523 -174.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.578 ' HB3' ' HB3' ' A' ' 76' ' ' GLU . 77.7 p -92.9 -60.33 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.3 19.99 79.79 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -164.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.46 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 8.8 t30 -127.34 133.18 24.79 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 115.19 -0.505 . . . . 0.0 109.822 -176.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 20.5 Cg_exo -65.0 -18.99 63.68 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.249 2.633 . . . . 0.0 114.704 -170.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 40.7 p -61.61 133.42 55.62 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.103 0.478 . . . . 0.0 111.769 -176.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.78 -29.17 70.51 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -177.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.497 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.97 -37.75 61.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.864 -176.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 69' ' ' SER . 5.3 mm-40 -55.04 -68.4 0.19 Allowed 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.821 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.5 t -64.4 -38.38 90.82 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.921 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.56 -61.66 2.34 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.765 0.317 . . . . 0.0 110.575 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -60.87 -50.01 75.15 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.247 -175.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.644 HD11 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -64.57 -43.7 96.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.088 -173.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.3 m -64.78 -34.27 77.95 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.635 0.255 . . . . 0.0 110.359 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -62.57 -40.2 96.11 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.644 HD12 HD11 ' A' ' 80' ' ' ILE . 82.3 mt -60.53 -45.75 92.67 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.132 0.491 . . . . 0.0 110.143 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.595 ' HZ3' ' HB1' ' A' ' 105' ' ' ALA . 44.3 m0 -60.79 -57.35 13.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.718 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.521 ' O ' ' HB2' ' A' ' 89' ' ' PHE . 26.0 tt0 -61.51 -23.6 66.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.075 0.464 . . . . 0.0 110.484 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.47 -31.89 58.38 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.026 175.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.2 m -94.23 -63.42 1.19 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.499 HD23 HG13 ' A' ' 118' ' ' ILE . 6.1 mp -62.23 -46.99 86.37 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -173.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.521 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 33.8 m-85 -71.36 -11.32 60.84 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.467 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -70.46 -46.3 64.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 173.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.79 -10.17 59.21 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.977 173.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.7 t30 72.59 48.42 0.22 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.14 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -74.36 100.83 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -73.39 84.38 1.46 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.43 0.633 . . . . 0.0 110.933 -175.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.776 HG11 HD23 ' A' ' 109' ' ' LEU . 4.5 m -111.29 162.01 9.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.115 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.437 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.1 tp60 -101.32 103.79 14.78 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 173.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.499 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -102.04 130.16 48.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.439 -175.834 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -119.63 136.44 54.39 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.6 tt -118.65 107.07 20.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.281 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.48 139.87 10.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.07 103.23 0.13 Allowed Glycine 0 C--O 1.224 -0.488 0 C-N-CA 120.342 -0.933 . . . . 0.0 111.584 -176.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 p -46.85 -35.27 6.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.528 ' HB2' HG21 ' A' ' 3' ' ' ILE . 12.7 t70 -53.23 -38.96 63.41 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.572 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 51.7 mtt180 -138.31 167.43 21.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 122.182 0.991 . . . . 0.0 112.821 -167.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.595 ' HB1' ' HZ3' ' A' ' 84' ' ' TRP . . . -143.88 153.84 42.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.543 162.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.45 HG12 ' SD ' ' A' ' 108' ' ' MET . 12.4 tt -127.0 145.56 34.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -170.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -122.34 120.11 33.06 Favored 'General case' 0 CA--C 1.523 -0.063 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.978 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.638 ' HG3' ' SD ' ' A' ' 63' ' ' MET . 4.3 mpp? -103.45 124.09 48.08 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 173.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.776 HD23 HG11 ' A' ' 95' ' ' VAL . 9.1 mt -128.46 141.21 51.47 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.406 0.622 . . . . 0.0 111.479 -177.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.1 mtp-105 -105.91 6.28 31.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.255 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -139.31 138.75 36.97 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -121.57 24.96 7.06 Favored Glycine 0 N--CA 1.453 -0.2 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.474 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.0 m -60.3 -37.75 81.51 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.243 0.544 . . . . 0.0 110.482 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -117.13 24.96 10.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.853 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.07 -47.51 82.63 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.201 0.524 . . . . 0.0 111.061 -178.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -76.72 -20.1 56.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.175 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.14 -48.88 31.76 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.245 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.499 HG13 HD23 ' A' ' 88' ' ' LEU . 8.4 tt -63.5 -41.19 91.81 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.07 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -58.83 -45.27 90.42 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.268 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.3 -40.73 87.11 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.29 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -65.11 -44.2 89.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.1 mt -60.74 -38.63 85.79 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.369 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 31.2 m -87.38 -12.0 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-O 120.853 0.358 . . . . 0.0 111.174 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 17.7 t -86.77 2.05 50.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.383 175.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.494 HE22 ' HZ2' ' A' ' 84' ' ' TRP . 58.5 mt-30 -60.75 164.31 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.149 -176.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -54.44 -61.64 2.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.32 178.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -80.95 -11.28 59.6 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.55 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 60.0 m 65.77 114.62 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.087 0.555 . . . . 0.0 110.979 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -102.61 144.9 30.42 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.914 -177.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -91.61 127.25 36.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.974 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 43.6 t -106.53 109.86 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.254 -174.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.488 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 31.4 p -92.7 127.12 38.09 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 83.0 mt -87.19 163.17 17.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.926 0.393 . . . . 0.0 111.593 -172.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.516 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 62.2 tt0 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 115.333 -0.848 . . . . 0.0 111.412 176.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 121.217 0.532 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -56.64 -38.78 72.6 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.841 -178.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.77 -49.27 77.15 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 177.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -55.72 -43.31 76.41 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.954 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.448 ' OD1' ' HD2' ' A' ' 104' ' ' ARG . 0.9 OUTLIER -58.46 -53.34 59.39 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.151 -177.254 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -52.68 -61.56 2.21 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.84 -61.45 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.509 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.78 -60.0 4.36 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.075 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.434 ' O ' HD23 ' A' ' 15' ' ' LEU . 26.2 mmt -59.4 -52.1 67.08 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.226 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.72 89.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.794 0.33 . . . . 0.0 111.084 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -72.15 -23.94 61.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.748 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.1 tp -80.71 -52.69 7.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.94 0.4 . . . . 0.0 110.625 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -68.08 -20.61 64.96 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.432 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -48.78 -38.28 21.48 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.504 0.668 . . . . 0.0 109.873 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -69.16 -43.68 73.78 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.002 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -59.04 -41.86 88.84 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 120.897 0.38 . . . . 0.0 110.715 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -61.71 -46.28 90.33 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.5 tmtt? -55.77 -40.88 73.24 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.439 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.434 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 7.4 m-20 -71.03 -44.67 65.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.33 -31.6 72.8 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 121.169 0.509 . . . . 0.0 109.808 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 6.2 m-20 -66.62 -44.98 80.6 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.766 174.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.3 mt -61.26 -34.18 59.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -69.09 -31.33 69.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.004 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.43 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.0 tp10 -64.99 -17.85 64.79 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.262 0.553 . . . . 0.0 110.071 170.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.68 29.42 13.6 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.239 -178.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -136.93 126.14 24.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 177.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.437 ' N ' HD21 ' A' ' 29' ' ' LEU . 2.9 mm? . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.614 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.257 0 CA-C-O 121.161 0.505 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 13.5 ptm -145.21 116.06 7.77 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.551 175.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.54 ' HE1' ' HG ' ' A' ' 133' ' ' LEU . 67.0 mtt -120.23 144.77 47.57 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.55 -174.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.522 ' HB3' ' HD3' ' A' ' 104' ' ' ARG . 41.6 m-85 -123.75 100.31 6.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.954 177.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.537 HG21 HD12 ' A' ' 122' ' ' LEU . 16.3 t -91.96 109.73 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -171.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 57.9 m -79.91 104.69 10.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.07 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.433 HG13 HG12 ' A' ' 80' ' ' ILE . 25.5 t -101.86 -58.82 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.049 0.452 . . . . 0.0 111.193 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.722 ' HB2' ' HA ' ' A' ' 103' ' ' ASP . 5.1 m -65.44 -69.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.217 -170.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.21 3.66 89.72 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.45 -0.66 . . . . 0.0 111.45 -171.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.434 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 10.0 t30 -123.13 136.16 26.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 33.6 Cg_exo -60.35 -19.34 57.78 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.284 2.656 . . . . 0.0 114.301 -173.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 m -81.63 140.96 34.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.24 -0.287 . . . . 0.0 110.446 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -72.75 -19.67 61.33 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -171.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -32.16 -61.02 0.26 Allowed 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.616 0.722 . . . . 0.0 112.29 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.41 -51.98 63.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.617 -169.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.576 HG23 HD13 ' A' ' 99' ' ' ILE . 9.6 t -66.04 -33.97 77.01 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.83 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.21 -52.63 57.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.897 0.38 . . . . 0.0 110.126 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.1 -49.4 76.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.104 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.514 HD13 ' HG2' ' A' ' 125' ' ' GLN . 10.1 tp -67.52 -42.96 87.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -175.11 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.4 m -68.7 -25.13 64.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.685 0.279 . . . . 0.0 110.405 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.8 t -67.31 -48.52 67.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 173.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.463 HD13 HD12 ' A' ' 80' ' ' ILE . 86.1 mt -55.24 -43.7 74.81 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.335 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.602 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.8 m0 -67.01 -43.83 81.9 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.118 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -55.16 -28.83 55.71 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.365 0.602 . . . . 0.0 109.592 175.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -76.26 -68.2 1.57 Allowed Glycine 0 CA--C 1.518 0.233 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.225 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.7 m -57.54 -54.4 47.24 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.3 mp -64.1 -29.0 70.16 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 111.281 -172.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -101.29 6.24 42.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.475 0.655 . . . . 0.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -89.68 -32.33 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 167.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.56 -14.39 37.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.637 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.0 m120 66.51 80.33 0.22 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.269 176.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -111.58 120.71 43.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.793 171.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.42 83.03 1.95 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.239 0.542 . . . . 0.0 110.254 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.603 HG21 ' HD2' ' A' ' 97' ' ' ARG . 12.5 m -111.07 148.78 14.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.852 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.5 tp60 -100.79 100.56 11.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.68 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -125.67 141.23 52.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.204 -169.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.461 ' O ' HG23 ' A' ' 106' ' ' ILE . 81.5 m-85 -138.72 135.63 34.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.304 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.576 HD13 HG23 ' A' ' 77' ' ' THR . 5.0 tt -87.0 89.76 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.536 0.684 . . . . 0.0 109.445 173.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -135.28 130.71 51.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.307 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 93.83 103.43 1.7 Allowed Glycine 0 C--O 1.225 -0.465 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -171.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -40.9 -34.9 0.45 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 69' ' ' SER . 7.8 p-10 -89.56 -48.4 7.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.521 0.2 . . . . 0.0 111.472 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.522 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 61.6 mtt180 -88.51 155.0 19.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -173.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -128.35 140.72 51.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.379 165.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.461 HG23 ' O ' ' A' ' 98' ' ' PHE . 8.0 tt -109.69 132.09 58.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 111.433 -172.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -123.22 107.69 11.98 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.261 176.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.406 ' SD ' HD11 ' A' ' 15' ' ' LEU . 66.5 mtm -102.1 118.81 37.68 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.52 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.614 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 28.6 mt -110.89 131.39 55.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.436 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 29.8 mmm-85 -88.99 4.26 48.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.347 0.594 . . . . 0.0 109.601 173.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -146.13 135.08 22.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.336 176.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -114.11 23.54 12.65 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.99 -176.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.2 t -64.67 -44.87 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -101.61 26.52 7.25 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.005 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -50.38 72.88 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.131 0.491 . . . . 0.0 111.753 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -28.54 62.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 -177.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -69.02 -48.41 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.42 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.573 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.2 tt -63.93 -41.41 92.41 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.474 ' HG2' HG11 ' A' ' 131' ' ' VAL . 14.1 tmtt? -57.56 -49.88 74.92 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 121.05 0.452 . . . . 0.0 110.229 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -56.65 -40.79 76.08 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.553 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -66.14 -47.71 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.918 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 88.8 mt -53.46 -44.77 69.18 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.403 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 28.7 m -81.77 -14.68 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.734 0.302 . . . . 0.0 111.481 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -74.26 1.55 11.17 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.769 0.427 . . . . 0.0 111.633 175.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.602 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.4 mp0 -76.85 164.53 25.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.401 0.619 . . . . 0.0 112.408 -174.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -79.76 -45.67 18.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.567 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -66.84 -3.17 6.22 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.726 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 43.6 t 62.51 91.32 0.07 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.222 0.534 . . . . 0.0 110.403 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.16 132.69 45.38 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.537 -177.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -108.27 124.53 50.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.841 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.504 ' HA ' ' HA ' ' A' ' 66' ' ' VAL . 6.5 p -102.84 127.97 56.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.103 0.478 . . . . 0.0 111.735 -173.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.6 m -87.06 121.33 29.37 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.54 ' HG ' ' HE1' ' A' ' 64' ' ' MET . 2.2 tt -105.2 113.45 27.05 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -172.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 C--O 1.235 0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.068 -179.98 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mm . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 120.359 0.123 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -56.41 -50.54 71.33 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.588 0.233 . . . . 0.0 111.609 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.86 -48.97 74.59 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -47.84 73.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.176 176.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.581 ' O ' ' HB2' ' A' ' 11' ' ' MET . 93.4 m-20 -53.12 -76.41 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.947 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.64 -64.07 0.94 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.832 -176.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.555 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -65.59 -61.24 2.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.846 -171.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -74.95 -30.49 61.23 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -168.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.639 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 10.0 mmt -71.42 -37.43 71.48 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.222 175.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.92 -48.08 83.15 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.16 173.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 85.7 mtt180 -59.05 -45.31 91.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.188 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.497 HD22 ' HD2' ' A' ' 98' ' ' PHE . 61.3 tp -71.1 -53.2 15.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.853 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 11' ' ' MET . 4.1 mm? -69.12 -18.59 63.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.129 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -48.74 -49.95 35.91 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.021 0.439 . . . . 0.0 110.799 175.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.445 ' HG3' ' N ' ' A' ' 18' ' ' TRP . 7.1 pt20 -66.71 -35.22 79.61 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.548 -177.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.464 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 76.8 m95 -67.03 -42.24 85.2 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.088 0.471 . . . . 0.0 110.428 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.07 -48.89 79.94 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.581 ' O ' HG13 ' A' ' 24' ' ' ILE . 88.2 tttt -57.59 -45.75 84.9 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.668 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -58.13 -54.16 50.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.984 0.421 . . . . 0.0 110.846 -177.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.54 -39.36 79.98 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.669 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 4.0 m-20 -72.56 -30.73 64.68 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.514 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 20' ' ' LYS . 67.9 mt -65.11 -37.75 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.91 -26.7 60.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.547 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 4.9 mm-40 -62.14 -17.32 57.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.233 166.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.46 9.76 62.75 Favored Glycine 0 N--CA 1.453 -0.203 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.824 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.91 124.96 47.3 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.429 ' N ' HD21 ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 C--N 1.327 -0.379 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.538 ' HB3' ' HG ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.425 0 CA-C-O 121.901 0.858 . . . . 0.0 113.254 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.605 ' HE3' ' HG3' ' A' ' 134' ' ' GLU . 72.9 mtm -142.32 133.66 26.36 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.307 168.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.586 ' HE3' ' HB2' ' A' ' 119' ' ' LYS . 63.0 mtt -114.64 129.15 56.64 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -172.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.524 ' HE1' ' HA ' ' A' ' 134' ' ' GLU . 43.5 m-85 -91.1 116.46 28.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 168.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -112.96 108.2 24.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.665 0.269 . . . . 0.0 110.965 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.761 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 37.8 m -77.15 106.52 8.92 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.418 HG23 HG23 ' A' ' 77' ' ' THR . 97.9 t -85.24 -61.05 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.081 0.467 . . . . 0.0 111.682 -172.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.5 t -91.65 -41.61 10.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.931 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.56 -10.18 65.41 Favored Glycine 0 C--N 1.33 0.243 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -167.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.531 HD22 HG21 ' A' ' 73' ' ' THR . 8.2 t30 -126.23 130.82 23.85 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 123.865 0.866 . . . . 0.0 109.004 178.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.3 -16.61 0.25 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.185 3.257 . . . . 0.0 116.263 -171.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.531 HG21 HD22 ' A' ' 71' ' ' ASN . 19.9 p -60.18 97.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.682 0.674 . . . . 0.0 112.347 -172.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.41 ' CA ' ' HB3' ' A' ' 102' ' ' SER . 40.0 tt0 -43.34 -30.92 0.57 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.132 -0.94 . . . . 0.0 112.415 176.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -35.04 -66.9 0.16 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 123.998 0.811 . . . . 0.0 111.935 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -62.93 -43.75 97.94 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.975 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.418 HG23 HG23 ' A' ' 68' ' ' VAL . 38.6 m -63.93 -39.8 94.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.282 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.54 -50.01 60.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.384 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.84 -54.16 45.97 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 120.985 0.422 . . . . 0.0 110.929 177.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.626 HD11 HD13 ' A' ' 83' ' ' LEU . 10.2 tp -67.07 -40.0 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.324 -174.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.466 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 70.5 m -61.48 -37.34 83.26 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.673 0.273 . . . . 0.0 110.394 176.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.9 m -61.02 -44.84 96.82 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.626 HD13 HD11 ' A' ' 80' ' ' ILE . 78.3 mt -58.53 -47.48 84.04 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 176.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.684 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 48.9 m0 -58.7 -45.87 88.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.093 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.6 mt-30 -58.51 -60.03 4.44 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.44 -40.06 10.73 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.342 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 m -73.17 -58.02 3.61 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 111.373 -178.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.3 mt -57.99 -54.14 50.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -174.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -65.94 -31.13 71.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.38 -174.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.66 -24.07 59.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.282 0.563 . . . . 0.0 109.723 176.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.13 14.4 12.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.43 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.5 t30 73.26 9.46 5.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.703 175.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -81.28 91.92 6.29 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.038 -0.413 . . . . 0.0 109.968 176.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.77 94.46 7.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.08 165.25 16.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.316 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.484 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.1 tp60 -104.53 152.97 21.74 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 177.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.526 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -155.65 126.82 7.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.78 0.324 . . . . 0.0 110.36 -177.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.497 ' HD2' HD22 ' A' ' 14' ' ' LEU . 15.8 m-30 -113.82 124.15 51.53 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 tt -102.32 88.77 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 122.136 0.97 . . . . 0.0 109.734 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.39 141.98 45.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.111 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 67.19 76.27 0.39 Allowed Glycine 0 C--O 1.224 -0.489 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -169.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.41 ' HB3' ' CA ' ' A' ' 74' ' ' GLU . 24.6 m -35.21 -34.6 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -165.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.76 -34.17 72.63 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.176 0.513 . . . . 0.0 111.849 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.483 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 88.3 mtt180 -128.09 134.69 49.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.162 0.506 . . . . 0.0 111.93 -171.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.64 128.56 54.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.539 -0.755 . . . . 0.0 108.975 173.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.6 tt -104.46 133.14 49.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 110.704 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -116.11 129.62 56.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.07 -177.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.572 ' HA ' ' HG2' ' A' ' 63' ' ' MET . 2.0 mpt? -108.87 122.71 47.77 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.679 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.538 ' HG ' ' HB3' ' A' ' 62' ' ' LEU . 0.8 OUTLIER -128.01 114.75 17.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 172.1 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -61.79 -34.32 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -170.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -118.38 111.49 18.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.101 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.54 48.46 3.9 Favored Glycine 0 C--N 1.332 0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.166 -174.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.4 t -68.39 -71.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.981 0.419 . . . . 0.0 110.003 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.1 p90 -80.54 30.17 0.3 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.631 177.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.82 -41.53 82.42 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.234 0.54 . . . . 0.0 111.445 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 21.0 m95 -75.11 -32.89 61.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.009 -174.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.83 -53.57 44.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.153 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.2 tt -61.62 -38.36 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.079 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.586 ' HB2' ' HE3' ' A' ' 64' ' ' MET . 24.5 ttpp -53.51 -55.55 24.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.144 0.497 . . . . 0.0 110.788 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.661 ' HA ' HG21 ' A' ' 123' ' ' VAL . 3.3 m-20 -64.22 -30.99 72.02 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.846 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -64.93 -36.51 84.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.959 0.409 . . . . 0.0 110.034 176.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 81.3 mt -67.43 -46.26 73.67 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.278 178.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.661 HG21 ' HA ' ' A' ' 120' ' ' ASP . 12.5 m -82.21 -4.51 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.582 -177.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.4 t -70.04 1.24 4.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.92 0.488 . . . . 0.0 111.765 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.684 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -83.19 143.11 30.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.007 0.432 . . . . 0.0 111.529 -174.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -43.89 -62.35 1.15 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.063 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 48.9 ttt180 -80.78 21.24 0.69 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 56.6 m 70.99 -166.94 0.15 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.701 0.4 . . . . 0.0 111.779 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 171.71 119.41 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.603 -176.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.761 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 34.8 mt-10 -87.17 144.14 26.98 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.2 p -138.72 139.72 40.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.926 0.393 . . . . 0.0 111.302 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 18.2 p -138.33 140.47 39.51 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 176.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 61.3 mt -88.4 154.31 20.48 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.639 0.257 . . . . 0.0 111.172 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.605 ' HG3' ' HE3' ' A' ' 63' ' ' MET . 1.7 tm-20 . . . . . 0 C--N 1.331 -0.218 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 176.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.766 HG12 ' HB3' ' A' ' 6' ' ' TYR . 15.0 tt . . . . . 0 CA--C 1.545 0.76 0 CA-C-O 122.316 1.055 . . . . 0.0 109.039 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -55.41 -43.41 75.25 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 114.495 -1.23 . . . . 0.0 112.274 -169.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.98 -46.13 71.59 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.082 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.766 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -58.57 -47.15 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.989 176.656 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.568 ' O ' ' HB2' ' A' ' 11' ' ' MET . 90.6 m-20 -55.15 -71.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.405 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -51.23 -69.47 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.093 -178.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.17 -58.75 7.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.746 -171.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.96 -45.97 55.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.915 -168.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.61 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 17.2 mmt -69.01 -43.27 75.14 Favored 'General case' 0 N--CA 1.461 0.125 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.707 -176.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.47 -49.94 67.19 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.835 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -67.95 -27.81 66.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.653 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -78.78 -52.09 8.86 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.891 0.377 . . . . 0.0 111.2 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.435 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -72.55 -25.13 61.25 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -173.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -59.75 -29.45 68.17 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -55.8 -58.11 9.21 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.854 174.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.1 m95 -58.94 -30.15 67.67 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.667 -178.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.82 -62.89 1.53 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.379 175.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.473 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.1 ttmt -57.37 -47.14 82.42 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.152 -178.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.42 -46.49 73.21 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 123.377 0.423 . . . . 0.0 110.632 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 28.6 t70 -61.64 -41.9 98.14 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.141 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -66.89 -24.87 66.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.08 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 20' ' ' LYS . 70.5 mt -71.28 -37.5 66.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 174.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -68.34 -31.55 71.02 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.571 173.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 22' ' ' ASP . 14.9 mm-40 -69.21 -35.38 76.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.349 0.595 . . . . 0.0 109.645 172.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.64 48.02 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.726 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -116.88 94.2 4.5 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.417 ' N ' HD23 ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.533 0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.027 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.466 HD21 ' HE3' ' A' ' 64' ' ' MET . 1.9 tm? . . . . . 0 C--O 1.235 0.296 0 CA-C-O 121.062 0.458 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.675 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 17.1 ptm -140.87 111.74 7.07 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.867 176.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.466 ' HE3' HD21 ' A' ' 62' ' ' LEU . 61.5 mtt -113.47 130.21 56.38 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.385 -174.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -100.05 118.86 37.31 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.421 HG21 HG12 ' A' ' 131' ' ' VAL . 35.4 t -113.94 101.7 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 -175.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.62 HG22 ' HB2' ' A' ' 130' ' ' GLU . 5.1 t -83.19 106.2 14.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 109.459 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.405 HG13 HG12 ' A' ' 80' ' ' ILE . 17.3 t -101.29 -60.78 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.831 -173.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.3 t -72.57 -59.7 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.685 -176.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 75.62 0.92 64.57 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.523 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.442 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 9.1 t30 -126.26 132.29 24.26 Favored Pre-proline 0 CA--C 1.535 0.367 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 32.6 Cg_exo -58.71 -17.91 38.2 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.628 2.886 . . . . 0.0 114.513 -171.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.457 ' HG1' ' HG2' ' A' ' 76' ' ' GLU . 36.1 p -57.9 107.16 0.43 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 111.912 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -47.61 -31.27 4.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.04 0.936 . . . . 0.0 112.641 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.533 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 11.9 mptt -49.29 -50.88 37.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.135 0.493 . . . . 0.0 111.081 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.457 ' HG2' ' HG1' ' A' ' 73' ' ' THR . 17.6 mm-40 -59.3 -50.33 74.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.452 -174.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.436 HG21 HD12 ' A' ' 99' ' ' ILE . 14.6 t -67.83 -39.47 83.88 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.793 -175.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.06 -53.3 59.91 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -54.95 -63.13 1.25 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.135 179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.405 HG12 HG13 ' A' ' 68' ' ' VAL . 11.4 tp -63.41 -46.35 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.599 -171.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 55.3 m -67.99 -31.72 71.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.488 -0.132 . . . . 0.0 111.159 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.1 t -67.73 -44.45 77.57 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 177.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 99.3 mt -60.69 -40.94 94.05 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.508 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 40.1 m0 -62.98 -47.79 81.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.664 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -55.73 -57.84 10.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.027 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -43.93 -58.34 4.33 Favored Glycine 0 C--N 1.333 0.395 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.991 173.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -49.53 75.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 95.3 mt -60.71 -56.57 19.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.083 -177.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -68.34 -20.3 64.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.07 -177.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -68.73 -38.0 79.85 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.164 0.507 . . . . 0.0 110.197 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.8 5.72 50.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.224 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 64.64 65.12 0.64 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.596 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 17.4 m-85 -102.1 88.16 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 168.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -77.21 72.57 3.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 109.785 -177.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.814 HG11 HD23 ' A' ' 109' ' ' LEU . 4.5 m -104.62 161.02 4.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.015 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.437 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.4 tp60 -102.0 105.42 16.18 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.636 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -119.96 145.35 46.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.972 -174.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.467 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 81.8 m-85 -130.97 127.01 37.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.068 0.461 . . . . 0.0 109.951 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.436 HD12 HG21 ' A' ' 77' ' ' THR . 7.5 tt -99.26 90.51 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.935 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -136.86 128.71 43.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.584 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.26 97.99 0.15 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 -172.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.9 m -45.19 -32.58 1.93 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -172.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.434 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 2.5 m-20 -57.47 -51.92 67.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.471 177.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.418 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 69.9 mtt180 -120.92 134.37 55.3 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -171.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.91 127.96 55.06 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 168.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.467 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 6.1 tt -98.71 132.94 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.989 0.423 . . . . 0.0 111.257 -177.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -124.22 123.8 41.05 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.593 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 76.6 mtm -128.12 146.81 50.59 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.267 0.556 . . . . 0.0 111.41 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.814 HD23 HG11 ' A' ' 95' ' ' VAL . 22.4 mt -133.28 137.64 46.1 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.436 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.37 -55.42 4.17 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 172.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -128.3 111.51 13.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.466 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.91 95.91 0.12 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.308 -176.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.5 t -70.66 -23.39 62.5 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 109.872 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.29 14.36 1.23 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.914 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.74 75.38 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.051 0.453 . . . . 0.0 111.529 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 16.8 m95 -79.49 -23.86 42.7 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.185 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -72.67 -48.45 39.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.881 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.1 tt -64.17 -41.29 91.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.6 -41.45 81.26 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.401 ' HA ' HG21 ' A' ' 123' ' ' VAL . 27.4 t70 -60.8 -40.8 94.04 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.153 177.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -60.66 -40.44 92.04 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.435 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 47.7 mt -65.96 -40.55 91.39 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.256 -178.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.401 HG21 ' HA ' ' A' ' 120' ' ' ASP . 24.6 m -81.07 -22.91 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 120.809 0.338 . . . . 0.0 111.245 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.5 m -87.17 2.7 49.11 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.127 0.489 . . . . 0.0 110.583 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.508 ' NE2' ' NE1' ' A' ' 84' ' ' TRP . 6.6 tp-100 -66.74 156.47 35.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.621 -174.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -45.16 -67.74 0.26 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.001 0.52 . . . . 0.0 111.879 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -69.77 -17.84 63.45 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.604 177.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 42.3 t 68.8 116.59 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.609 0.568 . . . . 0.0 109.919 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.59 143.28 32.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.934 -175.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.62 ' HB2' HG22 ' A' ' 67' ' ' THR . 38.9 mt-10 -91.66 113.39 25.64 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.01 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.421 HG12 HG21 ' A' ' 66' ' ' VAL . 37.5 t -104.25 138.73 27.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -178.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.5 p -125.54 136.34 53.22 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 62.4 mt -94.13 110.89 22.58 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.675 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 53.8 mm-40 . . . . . 0 C--N 1.325 -0.461 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt . . . . . 0 CA--C 1.536 0.434 0 CA-C-O 121.969 0.89 . . . . 0.0 108.796 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.5 ttm105 -51.95 -31.79 30.41 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.524 -176.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -54.73 -45.6 74.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.627 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.0 -44.04 98.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 178.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.568 ' O ' ' HB2' ' A' ' 11' ' ' MET . 1.1 m-80 -53.77 -70.39 0.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.45 -62.68 1.5 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.935 -175.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.49 -64.27 1.0 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.758 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -68.0 -39.44 83.23 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.672 -169.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.568 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 24.2 mmt -70.52 -45.99 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.979 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -59.65 -43.64 93.81 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.052 0.454 . . . . 0.0 110.484 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -72.54 -31.68 65.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.469 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.9 tp -71.59 -52.77 16.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.962 0.411 . . . . 0.0 110.29 177.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.76 -17.02 61.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.174 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 16.5 tp10 -51.07 -49.75 60.04 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 121.268 0.556 . . . . 0.0 110.206 173.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 21' ' ' ASP . 18.2 tt0 -64.93 -43.01 94.14 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 m95 -55.09 -41.88 72.16 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.612 0.57 . . . . 0.0 110.833 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.28 -52.32 66.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.621 ' HE2' HD11 ' A' ' 24' ' ' ILE . 88.2 tttt -62.22 -27.68 69.15 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.946 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 17' ' ' GLN . 35.6 m-20 -67.83 -49.39 62.47 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -72.27 -25.84 61.76 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.052 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -61.97 -54.6 39.45 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.285 0.564 . . . . 0.0 110.391 171.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.621 HD11 ' HE2' ' A' ' 20' ' ' LYS . 77.8 mt -59.17 -35.87 59.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.995 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.97 -42.64 99.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.195 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -78.2 3.29 15.62 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.034 0.445 . . . . 0.0 110.93 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.22 53.12 3.21 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 116.236 -0.438 . . . . 0.0 113.95 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -158.64 136.2 10.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.034 0.417 . . . . 0.0 111.171 175.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.567 HD12 HG12 ' A' ' 24' ' ' ILE . 2.5 mm? . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.403 HD13 ' HB3' ' A' ' 115' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 121.719 0.771 . . . . 0.0 112.738 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.44 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 18.0 ptp -136.47 127.27 27.37 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.739 -1.118 . . . . 0.0 108.786 172.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.7 mtt -110.35 125.32 53.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 0.0 111.344 -173.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.505 ' HE2' ' SD ' ' A' ' 11' ' ' MET . 49.8 m-85 -102.91 105.01 15.29 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.62 HG23 HD12 ' A' ' 122' ' ' LEU . 21.7 t -98.11 105.41 17.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.245 -171.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.8 m -79.02 103.5 9.01 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.607 HG11 HG12 ' A' ' 80' ' ' ILE . 26.0 t -96.18 -62.71 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.811 0.338 . . . . 0.0 111.739 -171.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.6 t -92.56 -64.3 1.12 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.426 -173.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.488 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 89.78 -9.25 77.86 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 -172.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -92.72 125.49 55.33 Favored Pre-proline 0 CA--C 1.532 0.273 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.38 -19.8 68.38 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.172 2.581 . . . . 0.0 114.21 -170.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.421 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.5 m -66.04 113.93 4.83 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 52.3 mt-10 -60.45 -24.65 65.39 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -168.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -49.96 -31.23 12.07 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.894 0.378 . . . . 0.0 111.593 -178.911 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.532 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 31.6 mm-40 -60.37 -60.09 4.37 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.083 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.619 ' HB ' ' HA ' ' A' ' 102' ' ' SER . 15.1 t -62.82 -33.43 75.21 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.511 -178.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -54.94 -59.29 4.94 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.08 176.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -57.47 -54.54 45.71 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.149 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.652 HD13 ' HG2' ' A' ' 125' ' ' GLN . 9.6 tp -63.91 -44.95 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.779 -171.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.413 HG22 ' HB ' ' A' ' 99' ' ' ILE . 39.5 m -67.03 -34.29 77.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.543 0.211 . . . . 0.0 110.61 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.2 t -63.62 -45.09 91.83 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.896 0.379 . . . . 0.0 110.201 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.6 mt -62.64 -44.73 95.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.553 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.402 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 20.8 m0 -65.37 -43.78 89.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.859 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -60.2 -29.71 68.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.313 0.578 . . . . 0.0 110.091 172.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -77.9 -26.12 61.02 Favored Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 112.307 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.0 m -96.11 -56.26 2.7 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.96 -49.26 76.25 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.702 0.287 . . . . 0.0 111.597 -175.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -71.05 -21.62 62.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.769 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.25 -35.09 66.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.232 0.539 . . . . 0.0 109.762 174.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.65 7.32 34.09 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.481 176.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 65.82 70.39 0.44 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.463 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -130.3 95.77 3.99 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.293 171.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -84.16 70.87 10.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.615 0.721 . . . . 0.0 109.669 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 31.8 m -95.77 169.48 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.07 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -101.48 104.7 15.64 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.877 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.488 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.4 OUTLIER -111.51 138.49 47.97 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.25 -178.376 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.436 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.4 m-85 -130.0 150.85 51.1 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 175.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.413 ' HB ' HG22 ' A' ' 81' ' ' THR . 6.9 tt -130.75 96.81 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.399 -171.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -149.01 133.38 9.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 80.59 102.72 0.3 Allowed Glycine 0 C--O 1.227 -0.314 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.083 -173.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.619 ' HA ' ' HB ' ' A' ' 77' ' ' THR . 18.9 t -53.85 -28.27 34.85 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.913 0.387 . . . . 0.0 111.924 -174.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 10.0 p-10 -61.42 -36.84 81.45 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -134.39 141.2 46.77 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.54 137.75 53.01 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 167.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.436 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 10.2 tt -111.81 128.24 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.15 0.5 . . . . 0.0 111.633 -172.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -121.18 117.96 28.45 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.615 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.2 mtm -115.76 133.47 56.0 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.716 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.2 mp -132.51 155.44 48.59 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.751 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -105.86 6.01 31.19 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 167.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -100.59 149.54 23.63 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.883 -177.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -131.36 19.16 4.87 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 175.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.9 t -93.98 -60.37 1.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.725 0.298 . . . . 0.0 110.222 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -99.07 8.26 45.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.937 0.398 . . . . 0.0 110.568 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.403 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -54.79 -38.03 66.79 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.21 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -76.11 -35.42 59.31 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.217 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -58.94 -52.5 65.48 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.406 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.585 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 4.3 tt -60.08 -42.53 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.34 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.496 ' HB3' ' HZ2' ' A' ' 119' ' ' LYS . 4.2 ttpm? -52.51 -54.88 26.62 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.344 0.592 . . . . 0.0 110.912 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.599 ' HA ' HG23 ' A' ' 123' ' ' VAL . 2.6 m-20 -65.17 -31.02 72.0 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.875 -177.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -64.48 -45.1 88.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.62 HD12 HG23 ' A' ' 66' ' ' VAL . 74.5 mt -58.36 -45.19 88.67 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.852 177.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.599 HG23 ' HA ' ' A' ' 120' ' ' ASP . 14.3 m -77.5 -17.51 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.758 0.313 . . . . 0.0 111.539 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -81.1 2.38 27.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 178.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.652 ' HG2' HD13 ' A' ' 80' ' ' ILE . 6.3 tp-100 -68.01 163.32 22.53 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.092 -174.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -66.08 -46.21 78.52 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.208 0.527 . . . . 0.0 109.752 -176.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -70.29 -20.94 63.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.432 174.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.4 m 66.11 167.33 0.21 Allowed 'General case' 0 CA--C 1.534 0.332 0 O-C-N 123.716 0.635 . . . . 0.0 109.296 -167.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.48 146.56 6.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.844 0.354 . . . . 0.0 111.322 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -94.53 112.78 24.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.553 176.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -96.55 112.34 28.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.218 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 65.3 p -95.43 132.16 40.8 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 67.7 mt -99.26 117.51 33.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -175.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.44 ' HB3' ' HG3' ' A' ' 63' ' ' MET . 10.8 tp10 . . . . . 0 C--O 1.237 0.412 0 CA-C-O 120.855 0.359 . . . . 0.0 110.54 -177.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.613 HG21 ' HB2' ' A' ' 103' ' ' ASP . 16.0 tt . . . . . 0 CA--C 1.54 0.575 0 CA-C-O 121.866 0.841 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.48 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 59.4 ttt-85 -59.55 -29.38 67.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.514 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -57.53 -46.5 83.77 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.44 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.1 OUTLIER -56.15 -44.33 79.17 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.702 173.223 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -53.45 -76.38 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -179.059 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.5 -59.83 4.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.485 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.568 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.94 -57.16 10.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.905 -171.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -69.58 -45.06 69.54 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.771 -171.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.532 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 25.4 mmt -63.72 -37.59 87.91 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.1 -50.58 72.68 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.848 0.356 . . . . 0.0 110.394 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.568 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 66.8 mtm180 -57.63 -45.5 85.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.268 -176.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -75.48 -52.23 11.17 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.537 -176.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.53 -15.95 60.33 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -172.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.62 -35.15 65.57 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.14 -42.04 99.41 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.485 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -61.44 -41.82 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.743 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.98 -42.74 94.28 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.5 ' O ' HG13 ' A' ' 24' ' ' ILE . 3.1 tttm -52.99 -52.09 59.47 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.048 176.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.424 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 13.5 m-20 -69.45 -35.63 75.84 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.442 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -56.9 -48.93 77.05 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -62.39 -44.81 95.57 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.12 177.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 20' ' ' LYS . 64.5 mt -59.03 -42.21 85.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.723 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.88 -13.2 59.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.538 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.65 -11.75 61.09 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.48 0.657 . . . . 0.0 109.312 166.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.24 28.1 11.18 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 114.288 171.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -154.07 152.5 30.54 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 169.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' N ' HD22 ' A' ' 29' ' ' LEU . 3.6 mm? . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.43 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.499 HD13 ' HE1' ' A' ' 64' ' ' MET . 0.7 OUTLIER . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.164 0.506 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 45.7 mtm -134.13 136.96 44.2 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 170.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.628 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 61.2 mtt -120.26 118.22 29.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.45 . . . . 0.0 111.185 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.419 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 13.1 m-85 -92.41 102.9 15.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 172.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 18.6 t -94.22 105.03 16.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.156 -170.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.437 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 47.7 m -77.25 101.4 6.22 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.015 178.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.459 HG13 HG21 ' A' ' 80' ' ' ILE . 42.8 t -101.43 -60.67 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.755 -177.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 t -81.75 -68.07 0.73 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.845 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.558 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 81.88 -10.71 51.15 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -169.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.416 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 8.5 t30 -109.25 133.73 20.69 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -64.5 -17.37 59.39 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.98 2.453 . . . . 0.0 114.702 -169.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.416 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 41.0 p -60.36 112.0 1.78 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.338 0.517 . . . . 0.0 111.221 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.423 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 10.4 pt-20 -57.98 -15.59 9.49 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.872 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -47.16 -54.18 11.25 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.075 175.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -58.5 -55.73 31.22 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.276 -0.874 . . . . 0.0 110.884 -172.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.476 ' HA ' HG23 ' A' ' 80' ' ' ILE . 10.6 t -63.73 -31.87 73.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.592 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.49 -52.95 62.38 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.208 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -58.03 -54.78 43.08 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.046 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.578 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.8 tp -65.32 -42.83 94.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.318 -173.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 86.2 m -68.38 -28.07 66.78 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.675 0.274 . . . . 0.0 110.436 178.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 48.3 t -62.85 -48.76 77.64 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 73.9 mt -58.67 -52.36 66.03 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.098 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.62 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 51.8 m0 -63.13 -29.97 71.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.406 -177.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.26 -60.19 3.73 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.42 -33.11 16.13 Favored Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.25 -0.887 . . . . 0.0 113.671 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.0 m -84.05 -67.89 0.76 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.77 -56.55 13.19 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 112.112 -172.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -76.53 -15.16 59.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.641 -170.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -80.32 -23.87 40.33 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.65 10.6 22.56 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.719 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.0 m120 70.63 24.89 4.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.826 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -71.54 100.07 2.18 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 173.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -85.36 69.86 10.75 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.495 0.664 . . . . 0.0 110.366 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 24.4 m -107.47 159.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.024 179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -100.53 136.93 39.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 176.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.535 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -140.58 135.55 31.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.088 -169.304 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.417 ' O ' HG23 ' A' ' 106' ' ' ILE . 28.4 m-85 -130.46 132.37 45.65 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.587 174.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.473 HD12 HG23 ' A' ' 77' ' ' THR . 6.9 tt -109.69 89.75 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 109.9 179.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -138.24 131.77 41.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.85 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.03 98.47 0.11 Allowed Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 -172.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.423 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 15.0 m -49.29 -27.76 4.14 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.984 0.514 . . . . 0.0 112.315 -174.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.613 ' HB2' HG21 ' A' ' 3' ' ' ILE . 35.7 t70 -47.33 -47.37 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.561 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.527 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 51.0 mtt180 -135.98 147.09 47.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.557 0.694 . . . . 0.0 112.616 -172.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -112.32 122.5 47.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 166.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.721 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.7 tt -98.49 133.63 40.14 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.74 -173.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -126.89 109.63 12.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.504 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.721 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.5 mpp? -96.8 124.57 40.82 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 178.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.419 HD12 HD12 ' A' ' 62' ' ' LEU . 6.0 mp -111.72 102.98 11.24 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.55 -32.88 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 176.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -141.63 126.89 18.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.173 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 167.11 118.4 0.44 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.521 -0.847 . . . . 0.0 113.161 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.5 m -81.25 -18.86 44.52 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -79.57 33.7 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.11 -175.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.432 ' O ' HG21 ' A' ' 118' ' ' ILE . . . -61.95 -59.5 5.02 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.135 0.493 . . . . 0.0 111.857 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -26.94 64.06 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.884 0.373 . . . . 0.0 110.241 -176.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.52 -52.5 52.17 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.368 177.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.572 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 tt -62.57 -39.58 85.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -58.16 -43.16 87.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.12 176.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.558 ' HA ' HG21 ' A' ' 123' ' ' VAL . 27.0 t70 -63.56 -37.48 87.47 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.233 0.539 . . . . 0.0 110.181 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -66.14 -33.06 74.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.829 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.0 mt -68.72 -47.73 65.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.355 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 120' ' ' ASP . 18.9 m -73.58 -8.67 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.2 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -65.32 -0.12 1.68 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.954 171.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.62 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.7 mp0 -101.59 85.94 2.85 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -178.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -55.71 -28.96 58.49 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.492 -175.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.537 ' O ' ' SG ' ' A' ' 128' ' ' CYS . 71.3 mtt85 -61.7 -46.25 90.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.18 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.537 ' SG ' ' O ' ' A' ' 127' ' ' ARG . 97.7 m -168.2 123.47 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -177.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.456 ' HB1' ' HA ' ' A' ' 123' ' ' VAL . . . -164.22 93.64 0.7 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.053 0.454 . . . . 0.0 111.526 -177.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.437 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 40.5 mt-10 -127.04 150.01 49.65 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 172.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.2 p -155.43 142.24 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.855 0.36 . . . . 0.0 111.348 -176.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 41.5 p -126.71 138.19 53.36 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.628 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 6.0 mp -97.68 172.24 7.83 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.569 -0.16 . . . . 0.0 110.569 -175.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -177.986 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 3' ' ' ILE . 13.6 tt . . . . . 0 CA--C 1.537 0.456 0 CA-C-O 121.547 0.689 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.479 ' HA ' HD21 ' A' ' 7' ' ' ASN . 49.6 ttt180 -56.02 -35.22 66.61 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.418 -177.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.23 -43.88 61.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.299 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -62.36 -42.21 99.22 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.883 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.537 ' O ' ' HB2' ' A' ' 11' ' ' MET . 49.0 m-80 -58.87 -66.4 0.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.865 -177.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -51.79 -60.82 2.73 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.454 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.554 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . . . -56.08 -70.95 0.1 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.58 -176.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 2.7 m-20 -60.9 -56.83 16.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.452 -174.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.715 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 10.8 mmt -60.84 -49.63 76.72 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.18 -172.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -64.14 -44.78 91.14 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.582 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.554 ' NH1' ' HA ' ' A' ' 9' ' ' ALA . 54.5 mtt85 -85.78 -1.95 57.74 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.456 ' O ' ' HB3' ' A' ' 17' ' ' GLN . 55.9 tp -95.56 -46.68 6.55 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 171.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.619 HD11 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -76.0 -20.96 57.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.373 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 31.3 tp10 -48.61 -40.54 27.88 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.776 0.798 . . . . 0.0 109.019 170.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 7.9 tt0 -60.26 -58.85 6.74 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 114.304 -1.317 . . . . 0.0 110.336 175.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 47.9 m95 -53.06 -38.45 62.48 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.682 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 43.3 mt-10 -67.52 -44.31 78.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.148 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -60.16 -50.0 75.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.158 177.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -58.03 -36.87 73.34 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 178.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.63 -50.48 72.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.411 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.73 -38.31 89.99 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.052 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.2 mt -63.02 -41.12 91.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.833 0.349 . . . . 0.0 110.546 178.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.44 -23.03 58.86 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.18 0.514 . . . . 0.0 109.883 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -72.19 -17.09 61.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.556 0.693 . . . . 0.0 109.368 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.48 21.29 35.05 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.898 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -132.43 115.83 16.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--N 1.33 -0.274 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.425 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.588 HD12 ' HE1' ' A' ' 64' ' ' MET . 3.3 tm? . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.619 ' SD ' HD11 ' A' ' 15' ' ' LEU . 21.6 ptt? -147.28 131.55 17.47 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.107 167.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.588 ' HE1' HD12 ' A' ' 62' ' ' LEU . 58.9 mtt -118.42 138.43 52.46 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.7 -170.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -103.83 114.31 28.47 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 168.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.548 HG21 HD11 ' A' ' 122' ' ' LEU . 21.6 t -114.39 112.03 38.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 118.007 0.367 . . . . 0.0 110.959 -172.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.645 HG23 ' HB2' ' A' ' 130' ' ' GLU . 7.9 t -98.16 123.81 42.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.06 -60.59 2.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.21 -174.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.7 t -92.8 -57.46 2.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.339 -172.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.61 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 91.25 29.64 12.16 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -168.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.643 ' HB3' ' HG3' ' A' ' 76' ' ' GLU . 10.3 t30 -125.19 132.77 24.39 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 122.858 0.463 . . . . 0.0 110.325 -178.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.4 -17.11 34.9 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.381 2.721 . . . . 0.0 114.406 -173.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 m -81.47 139.37 35.23 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 112.069 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -41.44 -49.24 3.9 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.536 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -39.1 -41.8 0.85 Allowed 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.773 0.671 . . . . 0.0 112.495 -167.688 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.643 ' HG3' ' HB3' ' A' ' 71' ' ' ASN . 9.8 mm-40 -59.74 -70.47 0.16 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.273 -174.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.448 HG22 ' HA ' ' A' ' 102' ' ' SER . 15.2 t -61.73 -38.64 88.67 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.859 0.361 . . . . 0.0 110.648 -178.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -53.67 -62.65 1.52 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.612 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.433 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 51.9 mt-10 -71.41 -38.69 71.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.816 -173.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.458 HD13 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -66.48 -39.94 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.395 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 90.2 m -69.02 -34.54 75.42 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.5 m -57.44 -45.21 84.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.109 174.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.458 HD12 HD13 ' A' ' 80' ' ' ILE . 83.6 mt -61.13 -51.86 67.29 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.225 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.4 m0 -62.25 -27.62 69.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.525 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.475 HE21 ' HB2' ' A' ' 89' ' ' PHE . 1.0 OUTLIER -72.19 -57.74 3.99 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 174.099 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.01 -12.72 7.53 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 115.693 -0.685 . . . . 0.0 113.672 176.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.4 m -95.92 -67.98 0.82 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 117.084 0.442 . . . . 0.0 110.862 174.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.5 mp -66.34 -56.45 11.05 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.713 -172.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.475 ' HB2' HE21 ' A' ' 85' ' ' GLN . 65.0 m-85 -66.13 -26.45 67.45 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.176 -176.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -72.16 -30.29 64.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 0.0 109.657 175.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.0 5.9 24.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.542 175.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 76.32 17.8 1.95 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.333 176.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -78.79 91.87 4.77 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -82.79 71.96 9.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.55 0.69 . . . . 0.0 109.967 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.6 m -88.14 178.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.421 178.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.575 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 4.9 tp60 -109.95 142.1 41.8 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 119.731 -0.787 . . . . 0.0 109.759 171.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.06 134.94 17.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.083 -178.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.426 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 29.5 m-85 -116.87 134.57 54.61 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 175.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -100.02 90.56 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.827 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.39 137.02 46.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.97 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.441 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 75.26 101.97 0.11 Allowed Glycine 0 C--O 1.225 -0.433 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 -169.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.448 ' HA ' HG22 ' A' ' 77' ' ' THR . 15.2 m -60.31 -10.08 4.27 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.61 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 4.1 p-10 -100.46 -4.85 28.03 Favored 'General case' 0 C--O 1.239 0.517 0 O-C-N 121.974 -0.454 . . . . 0.0 111.179 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 75.4 mtt180 -131.89 151.94 51.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.524 0.678 . . . . 0.0 111.831 -173.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.57 136.17 51.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.209 166.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.479 ' CD1' HD22 ' A' ' 15' ' ' LEU . 4.7 tt -112.46 128.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.429 . . . . 0.0 110.809 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -118.02 145.94 44.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.967 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.575 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -141.61 147.62 37.92 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-O 121.472 0.654 . . . . 0.0 110.837 175.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.6 mt -131.93 136.02 47.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.893 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -92.47 -31.2 15.35 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 164.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.14 110.22 22.21 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.942 -1.026 . . . . 0.0 108.361 170.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -113.45 13.42 23.17 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.303 -173.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.4 t -61.55 -20.17 62.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.757 0.313 . . . . 0.0 111.366 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -118.68 19.02 13.32 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.862 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.496 ' HB3' ' HG ' ' A' ' 62' ' ' LEU . . . -62.03 -44.93 95.65 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.01 -176.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -33.88 77.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -174.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -61.16 -46.69 89.49 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.191 0.52 . . . . 0.0 109.745 177.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -62.04 -42.28 94.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.828 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -52.99 -53.56 48.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.114 0.483 . . . . 0.0 110.181 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.429 ' HA ' HG23 ' A' ' 123' ' ' VAL . 0.8 OUTLIER -60.35 -36.44 77.99 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.035 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -65.19 -48.55 73.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 0.0 110.046 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 88.3 mt -53.6 -47.07 70.53 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.459 177.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 120' ' ' ASP . 21.3 m -79.5 -13.74 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.363 -178.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.9 t -74.56 2.28 10.08 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.857 0.361 . . . . 0.0 111.457 175.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -78.26 164.81 24.57 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.019 0.438 . . . . 0.0 111.586 -176.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.9 -63.66 1.07 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.04 -172.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -75.16 -5.28 43.52 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.216 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 45.7 t 61.42 104.41 0.02 OUTLIER 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.318 0.58 . . . . 0.0 109.79 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.62 133.14 45.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.845 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.645 ' HB2' HG23 ' A' ' 67' ' ' THR . 50.3 mm-40 -83.35 113.25 20.6 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.446 HG22 HG23 ' A' ' 66' ' ' VAL . 7.5 p -109.7 134.22 52.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.851 -175.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 22.9 p -122.37 143.24 49.78 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 31.6 mt -107.67 135.23 49.45 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -175.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.612 HG12 ' HD2' ' A' ' 6' ' ' TYR . 12.8 tt . . . . . 0 CA--C 1.542 0.643 0 CA-C-O 121.036 0.446 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.558 ' HA ' ' OD1' ' A' ' 7' ' ' ASN . 99.2 mtt180 -58.72 -13.52 6.21 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -177.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.47 -49.84 71.44 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.519 177.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.612 ' HD2' HG12 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -69.68 -37.61 76.71 Favored 'General case' 0 C--N 1.338 0.065 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.626 -178.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.558 ' OD1' ' HA ' ' A' ' 4' ' ' ARG . 14.7 m120 -48.9 -69.24 0.12 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 176.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.24 -68.12 0.22 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.047 -177.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.34 -59.97 4.45 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.665 -171.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 6' ' ' TYR . 23.5 t70 -66.91 -48.17 69.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.741 -170.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.645 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 6.0 mmt -69.98 -47.07 63.74 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.974 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.42 81.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.97 0.414 . . . . 0.0 110.764 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -68.87 -19.51 64.24 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.167 -178.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.18 -52.52 16.17 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 169.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.438 HD23 ' O ' ' A' ' 11' ' ' MET . 4.4 mm? -69.91 -15.08 63.01 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.808 -176.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -48.41 -55.49 10.7 Favored 'General case' 0 C--O 1.247 0.95 0 CA-C-O 121.533 0.682 . . . . 0.0 111.055 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -66.09 -29.59 69.95 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.53 -178.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.465 ' CH2' ' SD ' ' A' ' 108' ' ' MET . 45.2 m95 -64.05 -41.66 97.31 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -57.91 -47.91 81.45 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 24' ' ' ILE . 83.7 tttt -57.23 -40.71 78.11 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.04 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -62.17 -51.64 67.03 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.727 0.299 . . . . 0.0 110.948 -175.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.67 -25.48 60.28 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.745 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -39.67 85.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.767 0.318 . . . . 0.0 110.16 171.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.2 mt -62.5 -37.82 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -65.58 -34.95 79.44 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.922 175.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -71.37 -20.28 62.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.362 0.601 . . . . 0.0 109.68 174.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.05 35.05 7.28 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.796 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -143.82 132.13 22.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 176.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.406 ' N ' HD21 ' A' ' 29' ' ' LEU . 3.4 mm? . . . . . 0 C--O 1.238 0.459 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.415 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.442 HD11 ' HA3' ' A' ' 112' ' ' GLY . 3.0 tt . . . . . 0 C--O 1.235 0.312 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.506 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 22.7 ptp -126.41 124.54 40.41 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.155 -179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.451 ' HG2' ' CD2' ' A' ' 133' ' ' LEU . 55.6 mtt -107.68 118.03 35.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.466 -176.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.426 ' CZ ' HD12 ' A' ' 106' ' ' ILE . 9.5 m-85 -100.49 126.55 46.92 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.408 HG11 ' CH2' ' A' ' 84' ' ' TRP . 25.8 t -113.01 100.72 11.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.856 0.36 . . . . 0.0 110.303 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.614 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 34.5 m -74.31 99.01 3.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.719 175.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.591 HG11 HG22 ' A' ' 80' ' ' ILE . 58.5 t -96.4 -55.94 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.195 0.521 . . . . 0.0 110.634 -175.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.403 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 9.7 m -87.36 -63.3 1.33 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.483 -172.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 82.1 -10.62 52.68 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 -169.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.565 HD22 HG21 ' A' ' 73' ' ' THR . 10.1 t30 -126.52 137.53 30.57 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -55.6 -17.21 16.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.876 3.051 . . . . 0.0 115.261 -171.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.565 HG21 HD22 ' A' ' 71' ' ' ASN . 9.8 p -49.78 100.02 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -31.95 -44.94 0.09 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.928 1.291 . . . . 0.0 113.247 175.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.794 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.1 mptp? -51.58 -48.47 63.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.342 -166.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.403 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 14.7 mm-40 -58.66 -56.71 18.68 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.204 -174.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.496 HG22 ' HA ' ' A' ' 102' ' ' SER . 14.6 t -64.59 -37.13 86.5 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.559 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.91 -55.25 37.3 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.466 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 54.0 mt-10 -58.77 -55.44 35.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.769 -178.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.591 HG22 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -63.26 -47.4 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.499 -172.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.46 HG23 ' HB ' ' A' ' 99' ' ' ILE . 45.0 m -68.88 -31.67 70.77 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.206 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 18.9 t -68.82 -41.23 78.9 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 98.6 mt -61.21 -46.47 90.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.724 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 40.8 m0 -61.65 -36.58 81.19 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.841 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -59.52 -65.95 0.59 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -51.39 -28.73 21.28 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.325 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.8 m -87.82 -61.76 1.65 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.641 0.721 . . . . 0.0 111.923 -178.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.1 -53.68 46.72 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.261 0.553 . . . . 0.0 111.248 -176.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -76.76 -10.81 59.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.533 -171.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -84.92 -33.19 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 172.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.21 2.21 28.78 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.187 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 74.12 20.15 2.8 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.707 175.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -82.86 71.19 9.96 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 171.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.26 82.27 3.74 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.466 0.651 . . . . 0.0 110.665 -176.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.4 m -87.76 175.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.023 174.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.47 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 5.6 tp60 -99.77 120.68 40.12 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.611 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -119.72 125.89 49.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.719 -164.526 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -128.38 113.15 15.21 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.46 ' HB ' HG23 ' A' ' 81' ' ' THR . 6.0 tt -100.27 90.19 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.635 0.731 . . . . 0.0 109.505 175.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.76 125.01 51.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.498 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.01 102.01 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.147 -0.781 . . . . 0.0 111.147 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.496 ' HA ' HG22 ' A' ' 77' ' ' THR . 21.9 m -47.47 -22.14 0.42 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.418 ' HB2' HG22 ' A' ' 3' ' ' ILE . 17.4 t70 -54.34 -60.49 3.28 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.311 177.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -130.02 136.64 49.62 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.074 0.464 . . . . 0.0 111.688 -174.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -107.69 130.61 54.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 172.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.426 HD12 ' CZ ' ' A' ' 65' ' ' PHE . 7.8 tt -109.27 129.46 63.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-O 121.255 0.55 . . . . 0.0 112.267 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -112.7 122.21 47.01 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.188 172.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.465 ' SD ' ' CH2' ' A' ' 18' ' ' TRP . 61.1 mtt -101.16 133.09 46.23 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -110.62 131.65 54.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.653 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -77.5 -46.68 21.7 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 169.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -134.49 131.24 37.8 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.167 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . 0.442 ' HA3' HD11 ' A' ' 62' ' ' LEU . . . -120.26 56.95 0.59 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.99 -173.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.5 m -63.93 -51.17 65.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.284 0.564 . . . . 0.0 109.571 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -83.44 29.69 0.5 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.451 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.64 -49.14 77.44 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.943 0.402 . . . . 0.0 111.706 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -74.7 -23.7 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.951 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -68.43 -52.66 30.22 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.987 0.422 . . . . 0.0 109.895 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.594 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.0 tt -64.85 -40.92 90.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.279 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -58.61 -44.5 89.94 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.92 0.391 . . . . 0.0 110.119 177.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.35 -43.79 83.75 Favored 'General case' 0 C--O 1.239 0.553 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.92 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -63.54 -36.58 84.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.105 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.6 mt -66.31 -45.37 80.56 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.906 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 125' ' ' GLN . 32.9 m -78.52 -12.1 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.367 -178.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.3 t -62.6 2.13 0.31 Allowed 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.724 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -106.85 131.72 53.63 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 122.08 -0.387 . . . . 0.0 111.568 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -66.22 -18.07 65.12 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.909 170.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.454 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 24.2 mmm180 -58.5 -13.61 5.98 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.565 174.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.454 ' HB3' ' O ' ' A' ' 127' ' ' ARG . 49.5 t 78.25 143.7 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.891 0.744 . . . . 0.0 110.824 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.19 99.02 0.62 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.79 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.614 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 5.9 mm-40 -83.34 111.83 19.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 174.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 50.1 t -98.2 121.92 49.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.262 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 p -132.02 122.08 24.93 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.738 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.451 ' CD2' ' HG2' ' A' ' 64' ' ' MET . 21.8 mt -87.56 127.67 35.26 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.506 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 39.9 mm-40 . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 121.265 0.555 . . . . 0.0 110.096 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 CA--C 1.538 0.495 0 CA-C-O 120.919 0.39 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -58.51 -34.04 70.51 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -51.33 -50.87 58.61 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.276 0.56 . . . . 0.0 110.092 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.534 ' HH ' HG22 ' A' ' 100' ' ' VAL . 0.3 OUTLIER -60.14 -48.28 82.39 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.16 177.797 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 11' ' ' MET . 30.1 m-80 -51.73 -66.77 0.33 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.397 -176.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.59 -59.8 4.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.01 -64.76 0.84 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.945 0.403 . . . . 0.0 111.703 -173.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -64.95 -48.88 72.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.315 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' ' HE1' ' A' ' 65' ' ' PHE . 4.3 mmt -65.19 -44.72 87.49 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.897 -175.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.65 -51.07 66.78 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.802 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -62.59 -31.86 72.76 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.63 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.0 tp -76.41 -53.26 8.39 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.844 0.354 . . . . 0.0 111.181 177.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.639 HD13 ' SD ' ' A' ' 63' ' ' MET . 4.3 mm? -68.79 -17.41 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.046 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -60.11 -35.19 74.7 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.013 0.435 . . . . 0.0 109.873 174.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -62.42 -50.04 73.09 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.57 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 33.3 m95 -54.38 -42.71 70.68 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.797 -178.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -56.57 -54.44 45.86 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 173.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.625 ' O ' HG13 ' A' ' 24' ' ' ILE . 77.5 tttt -56.73 -35.65 68.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.358 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -64.01 -55.66 20.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.81 0.338 . . . . 0.0 111.136 -178.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -74.28 -22.52 59.26 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.572 -175.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.512 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 27.6 m-20 -75.59 -28.45 58.93 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 172.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.625 HG13 ' O ' ' A' ' 20' ' ' LYS . 63.6 mt -68.2 -32.62 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -65.58 -35.85 82.03 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.718 172.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.512 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 31.5 mm-40 -55.83 -16.83 5.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.006 0.431 . . . . 0.0 110.683 169.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.05 14.15 55.14 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.001 171.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -138.55 146.54 42.01 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.419 HD13 HG12 ' A' ' 24' ' ' ILE . 3.3 mm? . . . . . 0 C--O 1.236 0.375 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.819 -176.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.1 mt . . . . . 0 C--O 1.237 0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.639 ' SD ' HD13 ' A' ' 15' ' ' LEU . 44.9 mtm -140.09 110.23 6.54 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 174.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.632 ' HG2' HD21 ' A' ' 133' ' ' LEU . 63.0 mtt -110.3 133.04 53.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.401 -171.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.595 ' HE1' ' SD ' ' A' ' 11' ' ' MET . 68.0 m-85 -95.28 134.36 38.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 168.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 20.7 t -126.62 106.95 16.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.477 HG21 ' HB2' ' A' ' 130' ' ' GLU . 3.0 t -91.44 110.69 22.0 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.15 -60.86 2.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.068 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.416 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 10.8 m -71.76 -44.6 63.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.705 -173.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.62 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 69.08 2.96 34.38 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.238 -0.506 . . . . 0.0 111.852 -172.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . 0.531 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 53.3 t30 -126.25 132.26 24.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD2' ' OD1' ' A' ' 71' ' ' ASN . 10.4 Cg_endo -50.79 -16.52 2.45 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 123.556 2.837 . . . . 0.0 113.941 -179.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.8 p -64.74 90.96 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.988 0.423 . . . . 0.0 110.615 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -53.76 -30.57 45.03 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.015 -177.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -40.4 -46.35 2.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.469 0.708 . . . . 0.0 112.515 -178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.416 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 60.8 mm-40 -63.28 -49.95 72.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.455 -177.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.463 ' HA ' HG23 ' A' ' 80' ' ' ILE . 91.8 m -62.82 -34.78 78.03 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.763 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.96 -51.87 67.43 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.501 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.39 -47.21 80.06 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.293 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.523 HD11 HD12 ' A' ' 83' ' ' LEU . 10.9 tp -65.28 -41.78 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.029 -0.269 . . . . 0.0 110.927 -177.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.0 m -64.73 -34.05 77.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.935 0.398 . . . . 0.0 110.409 177.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 t -60.39 -44.48 95.63 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.523 HD12 HD11 ' A' ' 80' ' ' ILE . 84.2 mt -59.01 -44.42 91.69 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.018 175.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.582 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 52.5 m0 -56.64 -38.88 72.75 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.752 179.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -63.96 -56.34 15.87 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.72 -15.65 13.51 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.624 -0.717 . . . . 0.0 114.02 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.3 m -96.37 -65.24 0.98 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.574 0.687 . . . . 0.0 111.337 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.38 -51.57 68.94 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.353 -175.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -72.77 -20.16 61.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -67.54 -36.2 80.53 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 172.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.8 1.72 48.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.408 175.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 67.7 31.53 5.93 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.408 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -77.76 100.74 6.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.159 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -77.38 89.66 3.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.404 0.621 . . . . 0.0 110.617 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.1 m -119.52 157.32 21.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.241 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.57 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.8 tp60 -101.92 103.92 14.6 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.452 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -107.94 135.79 48.73 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.919 -177.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -120.71 121.28 37.92 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.0 tt -92.18 88.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 122.139 0.971 . . . . 0.0 109.268 174.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.534 HG22 ' HH ' ' A' ' 6' ' ' TYR . 7.3 p -145.28 134.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 177.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 99.9 103.06 2.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -166.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.512 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 16.4 m -37.3 -51.32 1.06 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -171.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.62 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.2 p-10 -101.05 -4.78 26.76 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.795 0.331 . . . . 0.0 111.441 -177.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -113.44 126.18 55.05 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.33 -168.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -115.24 130.77 57.0 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 170.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.466 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.9 tt -108.74 146.43 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.832 0.349 . . . . 0.0 111.445 -178.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -132.65 126.96 33.84 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.908 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.474 ' HG3' ' HG2' ' A' ' 63' ' ' MET . 3.6 mpp? -115.35 122.58 46.31 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 174.229 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 109' ' ' LEU . 5.7 mp -109.14 139.63 43.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.566 -178.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -104.2 5.93 35.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.27 0.557 . . . . 0.0 109.782 174.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -137.45 146.73 44.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.388 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -125.01 20.66 6.68 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.36 -174.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.6 m -76.74 -46.38 25.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.411 0.624 . . . . 0.0 110.127 179.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -105.48 22.44 15.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.076 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.29 -49.15 78.75 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.163 0.506 . . . . 0.0 111.611 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -23.83 56.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.115 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.33 -45.21 60.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.643 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.433 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.4 tt -66.26 -39.89 85.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -57.6 -41.01 80.36 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.122 0.487 . . . . 0.0 109.981 173.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.456 ' HA ' HG21 ' A' ' 123' ' ' VAL . 31.2 t70 -63.54 -41.15 98.47 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.587 178.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -62.51 -36.4 82.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.064 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 92.7 mt -66.43 -49.73 65.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.863 178.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.456 HG21 ' HA ' ' A' ' 120' ' ' ASP . 19.3 m -72.05 -13.44 16.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.932 0.396 . . . . 0.0 110.905 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 25.2 t -69.85 2.2 3.64 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.708 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.582 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 73.6 mt-30 -88.23 92.31 9.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.394 0.616 . . . . 0.0 110.192 -178.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -49.28 -40.96 36.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.72 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.433 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 98.1 mtt180 -56.6 -48.23 77.88 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 127' ' ' ARG . 51.3 t 165.8 138.12 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.461 0.475 . . . . 0.0 110.191 -174.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 179.54 110.69 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.495 0.497 . . . . 0.0 110.935 175.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . 0.477 ' HB2' HG21 ' A' ' 67' ' ' THR . 35.9 mt-10 -108.02 116.76 32.55 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 172.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.54 138.25 39.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.871 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.5 m -149.31 153.54 37.64 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.632 HD21 ' HG2' ' A' ' 64' ' ' MET . 70.7 mt -85.92 156.02 20.68 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.647 0.26 . . . . 0.0 110.465 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.583 ' HG2' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.384 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 175.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.597 HG12 ' HB3' ' A' ' 6' ' ' TYR . 14.0 tt . . . . . 0 CA--C 1.537 0.448 0 CA-C-O 121.95 0.881 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -65.97 -16.89 64.29 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.426 -174.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -57.39 -46.34 83.54 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.597 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.7 OUTLIER -62.6 -47.13 85.15 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.025 174.75 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 11' ' ' MET . 0.9 OUTLIER -54.0 -68.05 0.21 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -178.4 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -50.02 -64.59 0.76 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.255 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 13' ' ' ARG . . . -57.56 -62.53 1.72 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.277 -172.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.52 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 16.6 t70 -64.09 -63.39 1.17 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.56 -174.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.631 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 14.0 mmt -54.75 -55.75 26.57 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.815 0.34 . . . . 0.0 110.846 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.09 -53.78 10.2 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.3 -173.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 9' ' ' ALA . 35.5 mtt180 -80.13 -8.2 59.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.746 -167.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.52 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 52.5 tp -98.96 -52.98 3.4 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 171.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.26 -11.4 60.9 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.584 0.23 . . . . 0.0 111.358 -175.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -48.47 -48.94 37.42 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.18 171.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 11.3 pt20 -57.43 -38.16 73.95 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.382 -175.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.423 ' HB3' ' HE2' ' A' ' 108' ' ' MET . 76.4 m95 -64.63 -39.22 93.32 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.948 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.77 -47.38 85.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.561 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.3 ttpm? -63.32 -33.28 75.17 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.214 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -63.67 -48.37 77.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 109.946 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.77 -37.82 71.62 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.672 175.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 72.7 m-20 -68.43 -40.33 81.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.407 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.561 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.8 mt -62.51 -38.37 81.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 CA-C-O 121.363 0.601 . . . . 0.0 109.662 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -70.91 -28.69 64.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.237 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.439 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 10.0 tp10 -64.29 -12.07 38.05 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.127 172.047 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.13 21.87 34.27 Favored Glycine 0 C--N 1.333 0.381 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.687 173.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -152.03 153.06 33.24 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.184 0.516 . . . . 0.0 111.469 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.168 175.213 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.653 HD12 HD22 ' A' ' 133' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 121.416 0.627 . . . . 0.0 112.468 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' MET . . . . . 0.681 ' SD ' ' HE3' ' A' ' 108' ' ' MET . 35.3 mtp -126.74 148.67 49.87 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.621 ' HE3' ' HB2' ' A' ' 119' ' ' LYS . 62.4 mtt -130.79 118.79 21.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -175.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.46 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 25.1 m-85 -98.95 97.41 8.58 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 171.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.516 HG23 HD12 ' A' ' 122' ' ' LEU . 22.0 t -88.76 110.42 21.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.876 0.369 . . . . 0.0 111.466 -172.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.0 m -74.24 96.04 2.73 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.711 HG12 HG21 ' A' ' 80' ' ' ILE . 46.3 t -90.42 -48.46 14.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.314 0.578 . . . . 0.0 110.775 -174.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.808 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 43.7 t -90.97 -61.04 1.75 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.22 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 75.91 -3.2 52.09 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -168.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -119.78 134.38 23.91 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 109.695 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.16 -17.74 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.66 2.906 . . . . 0.0 114.832 -173.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.47 HG22 ' HD3' ' A' ' 75' ' ' LYS . 1.1 m -78.21 145.39 35.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.311 0.505 . . . . 0.0 110.343 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -85.27 -22.68 28.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -163.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.47 ' HD3' HG22 ' A' ' 73' ' ' THR . 0.0 OUTLIER -47.06 -42.04 17.98 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.503 0.668 . . . . 0.0 110.706 -173.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -65.62 0.57 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.419 -175.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.412 HG22 ' HA ' ' A' ' 102' ' ' SER . 15.3 t -63.73 -37.13 86.19 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.784 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.24 -58.31 9.08 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.136 0.493 . . . . 0.0 110.524 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -60.69 -46.82 88.91 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.433 -177.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.711 HG21 HG12 ' A' ' 68' ' ' VAL . 10.4 tp -68.16 -40.18 82.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.406 -175.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 97.4 m -64.96 -35.96 82.87 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.1 t -62.22 -42.61 99.46 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.983 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.99 -49.02 79.14 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.194 0.521 . . . . 0.0 110.673 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.42 ' HZ3' ' HB2' ' A' ' 105' ' ' ALA . 43.4 m0 -61.16 -41.01 96.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.144 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -55.49 -46.05 76.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 109.881 172.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -68.5 -22.37 74.94 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.747 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 m -96.28 -68.25 0.81 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.924 0.392 . . . . 0.0 111.858 -179.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 88' ' ' LEU . 7.3 mp -63.88 -45.89 87.36 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.85 -172.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -76.82 -0.39 23.78 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.769 0.318 . . . . 0.0 111.542 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -88.29 -36.09 16.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.28 -10.34 59.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.699 171.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 57.7 71.4 0.58 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.636 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -89.17 161.18 16.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.734 175.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -87.32 27.11 1.11 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.058 -177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.551 HG11 ' HG ' ' A' ' 109' ' ' LEU . 29.5 m -86.53 132.94 31.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.298 0.571 . . . . 0.0 111.219 -176.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -99.95 118.71 36.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 173.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.659 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -127.13 140.86 51.96 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.832 -172.106 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -125.77 147.03 49.52 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.492 176.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.4 tt -112.76 98.36 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.538 0.685 . . . . 0.0 109.638 177.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.8 p -149.16 138.66 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.669 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 77.97 102.46 0.19 Allowed Glycine 0 C--O 1.226 -0.363 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.412 ' HA ' HG22 ' A' ' 77' ' ' THR . 14.0 m -49.32 -32.37 11.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -173.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.808 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 10.3 p-10 -74.48 -16.81 60.84 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -177.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 53.9 mtt85 -134.44 156.4 48.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.88 0.848 . . . . 0.0 112.922 -169.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.42 ' HB2' ' HZ3' ' A' ' 84' ' ' TRP . . . -135.77 142.29 44.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 107.703 163.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 4.4 tt -117.15 137.39 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.54 -172.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -131.69 142.27 49.78 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.6 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.681 ' HE3' ' SD ' ' A' ' 63' ' ' MET . 70.6 mtp -127.51 119.65 26.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 177.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.551 ' HG ' HG11 ' A' ' 95' ' ' VAL . 5.0 mp -98.91 119.89 38.43 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.37 -32.65 58.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 175.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -112.64 111.55 22.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.593 169.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -85.3 22.94 8.99 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.309 -0.472 . . . . 0.0 112.642 -178.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -60.57 -49.06 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.993 0.425 . . . . 0.0 110.874 -179.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -97.36 29.96 3.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.735 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.51 ' HB1' ' HG ' ' A' ' 62' ' ' LEU . . . -56.12 -53.01 62.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.732 -178.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -75.54 -22.02 57.41 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.17 -177.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -68.3 -56.04 10.0 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 175.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.646 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.4 tt -59.47 -41.55 84.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.796 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.621 ' HB2' ' HE3' ' A' ' 64' ' ' MET . 65.7 tttm -55.06 -48.58 73.29 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.917 0.389 . . . . 0.0 110.337 177.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.04 -46.64 85.02 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.277 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -61.84 -41.29 97.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.47 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.646 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 78.7 mt -61.58 -41.2 97.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.664 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 27.7 m -87.29 -4.83 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.575 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.3 m -70.48 2.4 4.0 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.51 0.324 . . . . 0.0 111.736 174.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.525 ' NE2' HG12 ' A' ' 80' ' ' ILE . 46.2 mt-30 -59.69 162.93 4.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.404 0.621 . . . . 0.0 111.777 -177.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -85.97 -42.76 13.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.091 -0.959 . . . . 0.0 108.789 176.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -71.04 -22.82 62.09 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.478 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.3 m 72.86 137.39 0.05 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.919 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -137.72 156.08 48.39 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.542 -178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -109.24 130.48 55.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.007 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.427 HG22 HG13 ' A' ' 66' ' ' VAL . 58.2 t -109.22 124.36 65.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.896 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.46 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 40.3 p -102.93 137.38 41.21 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 174.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.653 HD22 HD12 ' A' ' 62' ' ' LEU . 50.1 mt -102.22 149.77 23.97 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.421 -172.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.568 ' HB3' ' HB2' ' A' ' 63' ' ' MET . 3.2 tm-20 . . . . . 0 C--O 1.234 0.266 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 3' ' ' ILE . 12.7 tt . . . . . 0 CA--C 1.537 0.45 0 CA-C-O 121.516 0.674 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -58.86 -49.72 76.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.93 -173.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -58.52 -42.69 88.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.469 -176.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.29 -48.83 80.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.077 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.606 ' HA ' ' SD ' ' A' ' 11' ' ' MET . 21.9 m-80 -60.38 -69.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.982 -179.097 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -49.53 -66.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.17 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.71 -60.37 3.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.914 -172.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -70.7 -44.54 66.72 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.155 0.502 . . . . 0.0 110.788 -169.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.606 ' SD ' ' HA ' ' A' ' 7' ' ' ASN . 71.0 mtp -74.51 -34.71 63.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.749 -172.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.54 -34.55 76.04 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.859 173.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 -62.8 -39.24 93.66 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.756 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 pp -84.05 -32.04 25.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.035 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.41 HD23 ' O ' ' A' ' 11' ' ' MET . 3.5 mm? -69.28 -22.6 63.8 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.773 0.321 . . . . 0.0 110.273 174.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -48.8 -39.38 25.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.289 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -60.16 -46.32 90.07 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.347 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.463 ' CH2' ' HG3' ' A' ' 108' ' ' MET . 57.9 m95 -60.79 -42.14 96.98 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.179 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.06 -47.36 86.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.564 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.5 tttt -62.99 -34.21 77.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.51 178.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.19 -54.22 48.45 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.453 0.168 . . . . 0.0 111.117 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.41 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.5 p-10 -70.65 -26.71 63.58 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.093 -178.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 11.5 m-20 -62.3 -48.43 79.91 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.071 0.462 . . . . 0.0 110.472 172.069 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 20' ' ' LYS . 80.7 mt -59.66 -40.39 82.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.753 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -67.53 -30.73 70.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.399 178.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 74.3 mm-40 -60.43 -15.37 25.82 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 110.447 171.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.22 34.65 6.63 Favored Glycine 0 C--N 1.333 0.377 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.414 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -158.66 149.76 20.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.758 0.313 . . . . 0.0 110.247 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.433 ' N ' HD21 ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.437 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 32.5 mtm -132.45 128.71 38.06 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 169.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.466 ' HE2' ' O ' ' A' ' 115' ' ' ALA . 60.2 mtt -110.48 122.43 47.7 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.929 0.395 . . . . 0.0 112.049 -171.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -95.62 106.68 18.8 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 169.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 23.3 t -99.67 112.83 33.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.67 0.272 . . . . 0.0 110.768 -174.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.788 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 25.8 m -85.48 109.66 18.64 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.599 HG13 HG21 ' A' ' 80' ' ' ILE . 42.7 t -94.66 -62.97 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 111.641 -171.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 52.8 p -93.6 -48.06 6.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.201 -173.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 77.66 9.24 87.01 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -165.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -126.22 129.22 24.27 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 123.618 0.767 . . . . 0.0 109.342 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.462 ' O ' ' HB3' ' A' ' 102' ' ' SER . 47.8 Cg_endo -65.64 -18.45 58.87 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.18 2.587 . . . . 0.0 114.816 -169.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.439 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.7 m -63.93 123.69 19.61 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.216 0.462 . . . . 0.0 110.944 -175.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -50.66 -29.04 10.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.759 0.824 . . . . 0.0 112.711 -175.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.439 ' HG3' HG22 ' A' ' 73' ' ' THR . 25.2 mtpp -38.06 -60.74 0.72 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.447 0.699 . . . . 0.0 112.702 -176.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.98 -59.07 6.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.738 -171.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.6 t -60.65 -43.03 98.09 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 123.119 0.262 . . . . 0.0 110.999 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.83 -61.91 2.26 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.957 0.408 . . . . 0.0 111.081 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.1 -50.22 74.22 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.053 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.599 HG21 HG13 ' A' ' 68' ' ' VAL . 7.5 tp -64.45 -41.81 93.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.673 -173.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -66.34 -34.37 77.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.692 0.282 . . . . 0.0 110.652 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' A' ' 85' ' ' GLN . 22.7 t -60.8 -43.45 98.14 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.331 0.586 . . . . 0.0 109.545 174.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.2 mt -64.29 -37.25 86.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.161 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' TRP . . . . . 0.573 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 46.3 m0 -67.11 -29.28 68.98 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.419 178.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.492 ' HB3' ' O ' ' A' ' 82' ' ' SER . 30.8 tt0 -62.51 -55.21 29.67 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.2 -26.95 51.31 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.429 -0.805 . . . . 0.0 113.432 175.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.3 m -86.87 -70.39 0.61 Allowed 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.387 -0.478 . . . . 0.0 111.411 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -53.6 -50.2 66.14 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -173.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.419 ' CD2' ' HA ' ' A' ' 85' ' ' GLN . 57.0 m-85 -77.25 -24.15 51.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -170.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -82.38 -19.97 38.11 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.73 10.41 7.65 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.565 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 74.79 15.1 3.23 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.729 0.812 . . . . 0.0 112.486 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -89.79 153.88 20.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -149.19 77.44 1.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.579 0.704 . . . . 0.0 110.039 176.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 29.4 m -89.36 176.59 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.831 174.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.792 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 5.8 tp60 -100.3 133.77 44.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 173.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.591 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.04 133.28 35.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.93 -164.524 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.421 ' O ' HG22 ' A' ' 106' ' ' ILE . 77.4 m-85 -137.85 132.66 32.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 176.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -89.14 88.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.816 0.817 . . . . 0.0 109.298 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.532 HG13 ' HE3' ' A' ' 11' ' ' MET . 3.6 p -136.96 137.9 46.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.777 -179.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.96 102.09 1.13 Allowed Glycine 0 C--O 1.222 -0.618 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -166.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 15.5 m -46.9 -36.11 7.2 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -101.18 9.84 41.48 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.788 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 86.3 mtt85 -142.96 159.87 41.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.635 0.731 . . . . 0.0 112.34 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.53 144.69 51.57 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.0 168.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 98' ' ' PHE . 13.2 tt -114.76 141.64 30.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 120.999 0.428 . . . . 0.0 111.189 -177.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -135.21 106.87 6.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.165 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.792 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.3 OUTLIER -93.47 121.6 35.03 Favored 'General case' 0 C--O 1.243 0.752 0 CA-C-O 121.339 0.59 . . . . 0.0 110.118 176.12 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.433 HD11 ' N ' ' A' ' 109' ' ' LEU . 5.5 mp -105.45 120.98 42.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.153 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -54.66 15.61 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -112.51 111.4 22.2 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.42 174.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.27 56.6 4.77 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.249 -0.5 . . . . 0.0 113.183 -175.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.6 m -69.05 -29.38 67.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.868 0.366 . . . . 0.0 111.162 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -124.6 29.32 6.3 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.27 0.557 . . . . 0.0 110.905 -177.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.466 ' O ' ' HE2' ' A' ' 64' ' ' MET . . . -58.72 -43.11 90.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.716 -178.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 16.6 m95 -72.55 -34.43 67.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.724 -175.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.88 -51.29 65.27 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.506 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.1 tt -63.09 -38.64 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 178.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 23.2 ttpp -53.04 -57.99 8.5 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.126 0.488 . . . . 0.0 110.623 176.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.662 ' HA ' HG21 ' A' ' 123' ' ' VAL . 33.2 m-20 -68.18 -26.56 65.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.211 -176.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -65.21 -43.07 92.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.8 mt -72.69 -37.75 67.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.61 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.662 HG21 ' HA ' ' A' ' 120' ' ' ASP . 14.1 m -73.37 -26.03 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.803 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 18.7 t -85.61 3.69 39.66 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.74 176.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . 0.573 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 6.3 tp-100 -65.54 158.64 26.49 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.937 -170.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.7 -68.7 0.28 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.722 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -73.09 4.86 3.87 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.553 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.5 m 71.42 149.54 0.09 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.317 0.647 . . . . 0.0 111.398 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 68' ' ' VAL . . . -171.05 103.76 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.402 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -91.27 130.92 37.08 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.301 0.572 . . . . 0.0 110.515 -179.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 45.5 t -92.01 144.26 9.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.443 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 85.9 m -124.99 136.11 53.42 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 90.6 mt -96.51 125.87 41.3 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 110.573 -174.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.236 0.353 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.485 1.905 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 1' ' ' GLY . 18.1 t70 161.32 123.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 -172.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.414 HD11 ' HB2' ' A' ' 103' ' ' ASP . 0.6 OUTLIER 72.62 -28.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.517 0.727 . . . . 0.0 112.649 174.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -54.57 -22.68 13.92 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.684 0.278 . . . . 0.0 111.625 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.36 -45.14 88.81 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.515 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -67.95 -40.66 83.2 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.676 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.562 ' O ' ' HB2' ' A' ' 11' ' ' MET . 81.0 m-20 -51.12 -69.05 0.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.641 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -53.49 -64.23 0.89 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.295 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.56 -58.69 4.26 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.302 -172.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 5.8 m-20 -70.17 -34.69 73.3 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -171.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.562 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 29.8 mmt -68.96 -41.55 77.84 Favored 'General case' 0 C--O 1.227 -0.132 0 C-N-CA 119.691 -0.804 . . . . 0.0 109.243 176.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.05 -49.75 68.29 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -66.49 -39.56 88.8 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.298 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.487 HD21 ' HD2' ' A' ' 98' ' ' PHE . 57.4 tp -66.9 -51.46 55.07 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.877 0.37 . . . . 0.0 110.891 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.51 HD11 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -69.99 -29.48 66.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.259 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.29 -34.98 66.98 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.061 0.458 . . . . 0.0 110.169 177.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -62.19 -53.02 61.23 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.89 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -57.74 -36.14 71.67 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.987 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -61.5 -50.04 74.3 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.508 ' O ' HG13 ' A' ' 24' ' ' ILE . 31.8 ttmt -65.4 -35.24 80.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.343 -177.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -66.22 -44.93 82.42 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.867 0.365 . . . . 0.0 110.043 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -61.63 -33.5 74.05 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.894 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.27 -42.1 72.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.952 175.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 20' ' ' LYS . 71.5 mt -61.11 -36.6 73.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -70.09 -35.1 73.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.482 175.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.88 -24.63 66.1 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.26 24.36 22.14 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.458 -0.792 . . . . 0.0 114.042 174.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -159.17 156.8 29.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 117.062 0.431 . . . . 0.0 110.454 172.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.371 -178.164 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.4 mt . . . . . 0 N--CA 1.468 0.443 0 CA-C-O 121.385 0.612 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.51 ' SD ' HD11 ' A' ' 15' ' ' LEU . 55.1 mtm -138.12 145.34 41.51 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 170.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.529 ' HG2' HD23 ' A' ' 133' ' ' LEU . 64.3 mtt -128.37 134.2 48.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.886 0.374 . . . . 0.0 111.829 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.42 ' CZ ' ' HG2' ' A' ' 134' ' ' GLU . 43.7 m-85 -98.03 121.65 40.21 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 166.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 39.3 t -116.38 104.16 16.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.595 0.236 . . . . 0.0 110.777 -174.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.449 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 86.9 m -72.41 107.66 5.1 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 174.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.724 HG11 HG21 ' A' ' 80' ' ' ILE . 42.3 t -101.09 -62.92 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.718 0.294 . . . . 0.0 111.204 -173.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.7 m -92.62 -45.81 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.867 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.66 10.69 67.71 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.799 -0.921 . . . . 0.0 110.799 -169.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.503 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 30.3 t30 -126.11 129.23 24.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 123.615 0.766 . . . . 0.0 109.096 -177.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.503 ' HD2' ' OD1' ' A' ' 71' ' ' ASN . 13.8 Cg_endo -55.15 -18.15 17.02 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.549 2.833 . . . . 0.0 114.225 -176.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.402 HG21 ' HB2' ' A' ' 75' ' ' LYS . 24.4 m -58.77 93.06 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.919 0.39 . . . . 0.0 111.611 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.448 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 2.6 mp0 -50.81 -23.66 2.92 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.289 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.568 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -59.61 -41.22 89.88 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.757 -174.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.26 -53.53 55.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.679 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.502 ' HA ' HG23 ' A' ' 80' ' ' ILE . 17.5 m -62.77 -32.88 74.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.54 -60.09 4.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.316 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 42.0 mt-10 -55.71 -55.82 27.71 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.575 0.703 . . . . 0.0 110.867 -178.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.724 HG21 HG11 ' A' ' 68' ' ' VAL . 10.7 tp -65.1 -48.93 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.073 -171.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.495 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 89.8 m -63.56 -29.83 71.03 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 122.244 -0.285 . . . . 0.0 110.662 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.3 t -59.41 -46.68 88.04 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.491 HD13 HD13 ' A' ' 80' ' ' ILE . 55.6 mt -58.39 -48.48 80.48 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.092 175.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.516 ' NE1' HG13 ' A' ' 80' ' ' ILE . 28.7 m0 -59.27 -39.45 82.93 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.098 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.5 mt-30 -64.68 -58.06 7.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.47 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -53.42 -22.26 15.38 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-N 115.71 -0.677 . . . . 0.0 113.91 176.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -88.39 -61.72 1.65 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 117.453 0.627 . . . . 0.0 111.306 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.58 -47.51 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.808 -173.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.401 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 71.3 m-85 -78.69 1.12 24.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.276 -176.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 48.8 t30 -89.34 -37.6 14.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 177.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.44 2.36 48.03 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.637 176.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.4 t30 60.87 89.32 0.08 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.268 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -114.93 140.44 49.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.531 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.66 66.67 1.08 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 110.408 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.9 m -134.71 163.51 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.832 -177.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -139.96 148.83 42.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 173.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.505 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -133.76 137.58 45.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.523 0.202 . . . . 0.0 110.591 -173.531 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.487 ' HD2' HD21 ' A' ' 14' ' ' LEU . 22.9 m-85 -124.77 136.28 53.72 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.3 tt -109.04 89.95 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.463 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.3 p -132.07 125.37 54.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.254 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.515 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 70.91 100.99 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.126 -174.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.448 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 3.0 m -56.61 -14.88 3.56 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -173.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.414 ' HB2' HD11 ' A' ' 3' ' ' ILE . 19.7 t70 -57.57 -51.36 69.78 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.2 mtt180 -134.36 132.39 39.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.614 -174.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -96.21 136.95 35.99 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 168.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.635 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.9 tt -105.62 136.95 37.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.131 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.433 ' CZ ' ' HE3' ' A' ' 84' ' ' TRP . 25.3 m-85 -132.09 116.98 17.73 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.022 -176.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.635 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.1 mpp? -100.45 121.03 40.88 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.435 HD11 ' N ' ' A' ' 109' ' ' LEU . 4.9 mp -104.31 119.74 39.64 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.455 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 19.0 mmm-85 -82.36 -16.17 50.15 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -126.72 126.35 43.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.613 174.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.73 10.53 59.04 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 121.137 -0.554 . . . . 0.0 113.502 -175.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.1 m -63.72 -50.53 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.247 0.524 . . . . 0.0 110.319 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -91.93 24.59 3.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.681 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.28 -53.95 52.43 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.087 0.47 . . . . 0.0 111.313 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -71.71 -17.08 62.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.824 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -74.91 -49.96 18.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.241 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.591 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 5.1 tt -62.97 -44.91 99.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -55.15 -45.43 75.68 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.478 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.47 -42.95 93.21 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.351 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.01 -39.27 89.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.623 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 33.5 mt -68.51 -38.12 80.64 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.175 -178.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 18.8 m -84.28 -16.88 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.24 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.1 t -75.53 1.57 13.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.399 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -87.71 160.54 18.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.875 0.369 . . . . 0.0 111.53 -173.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -52.48 -66.8 0.32 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.427 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -71.94 -21.37 61.62 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.894 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.8 m 68.68 134.14 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.167 0.587 . . . . 0.0 111.581 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.436 ' HB3' ' HB3' ' A' ' 122' ' ' LEU . . . -100.65 147.56 25.84 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.423 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.449 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 38.7 mt-10 -99.83 117.72 34.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.113 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 29.9 t -110.01 134.15 53.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.384 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 24.1 p -137.72 145.73 42.88 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.605 ' HB2' ' HG2' ' A' ' 137' ' ' MET . 79.1 mt -86.51 158.9 19.45 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.636 0.255 . . . . 0.0 110.654 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.42 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -76.57 141.3 41.18 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.93 -179.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 70.8 -80.46 0.45 Allowed Glycine 0 CA--C 1.518 0.275 0 CA-C-N 116.329 -0.396 . . . . 0.0 112.901 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -132.68 152.67 51.63 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 122.754 0.422 . . . . 0.0 110.467 -176.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.605 ' HG2' ' HB2' ' A' ' 133' ' ' LEU . 73.3 mtp -115.54 142.35 46.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.133 177.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.427 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 84.3 m-85 -76.35 -43.85 3.43 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.879 176.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 76.2 Cg_endo -83.03 149.23 13.63 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.102 1.868 . . . . 0.0 112.016 173.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 78.55 42.6 13.69 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 121.174 -0.536 . . . . 0.0 112.31 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 96.5 mttt . . . . . 0 C--O 1.234 0.285 0 N-CA-C 110.521 -0.177 . . . . 0.0 110.521 178.581 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.73 0 N-CA-C 112.091 -0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -167.78 -41.26 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.168 0.509 . . . . 0.0 110.516 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.771 HG12 ' HB3' ' A' ' 6' ' ' TYR . 13.6 tt -111.03 35.26 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-O 122.028 0.918 . . . . 0.0 110.126 -175.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.507 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 72.0 ttt-85 -63.75 -24.11 67.63 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.006 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.21 -42.55 99.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.362 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.771 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -57.94 -47.06 84.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.374 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.532 ' O ' ' HB2' ' A' ' 11' ' ' MET . 22.2 m-80 -47.52 -70.63 0.09 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.311 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.56 -61.95 2.13 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.996 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -57.24 -68.94 0.18 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.466 -174.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 4.5 m-20 -61.3 -48.69 80.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.257 -0.402 . . . . 0.0 112.07 -173.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.621 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 7.5 mmt -59.67 -46.38 89.22 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.273 -175.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.22 80.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.006 0.431 . . . . 0.0 111.251 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 86.8 mtt180 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.255 -174.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.457 HD13 ' N ' ' A' ' 15' ' ' LEU . 4.4 pp -89.25 -29.57 19.13 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.369 175.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.1 OUTLIER -63.71 -30.94 71.98 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 175.469 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -48.16 -42.06 28.54 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.914 177.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -62.1 -52.54 63.45 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.403 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.505 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 48.0 m95 -62.35 -39.4 92.98 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.376 -176.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.69 -48.22 80.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.654 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.536 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.3 tttt -62.11 -48.0 82.13 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.032 -178.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -44.93 86.93 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.132 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -57.6 -45.14 85.66 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.073 0.463 . . . . 0.0 110.04 176.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -62.2 -41.52 98.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.954 177.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 20' ' ' LYS . 91.1 mt -60.59 -40.86 85.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.196 0.522 . . . . 0.0 109.999 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -67.19 -31.61 72.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.813 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.33 -10.65 17.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.324 0.583 . . . . 0.0 110.198 172.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.93 33.02 7.57 Favored Glycine 0 CA--C 1.518 0.227 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.991 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -159.46 147.23 17.27 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 171.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.8 mm? . . . . . 0 C--O 1.235 0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.013 -175.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.606 HD11 HD23 ' A' ' 133' ' ' LEU . 44.2 tp . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.809 ' HE2' ' HG3' ' A' ' 108' ' ' MET . 79.8 mtp -135.08 135.11 40.98 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 166.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.517 ' SD ' HD13 ' A' ' 109' ' ' LEU . 86.9 mtp -115.84 119.38 35.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.845 0.355 . . . . 0.0 111.397 -171.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.546 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 49.6 m-85 -95.16 123.18 38.52 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.433 HG21 HD12 ' A' ' 122' ' ' LEU . 43.2 t -124.04 109.06 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 117.794 0.27 . . . . 0.0 110.939 -173.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.464 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 28.3 m -74.0 98.49 3.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.608 HG13 HG22 ' A' ' 80' ' ' ILE . 11.4 t -87.63 -58.42 3.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.296 -171.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.597 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 34.7 t -89.92 -58.87 2.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.993 -174.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 88.41 -10.76 70.27 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.512 HD22 HG22 ' A' ' 73' ' ' THR . 11.4 t30 -122.98 132.62 24.27 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.938 0.495 . . . . 0.0 109.7 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 49.4 Cg_exo -56.99 -16.17 19.76 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.139 3.226 . . . . 0.0 115.639 -172.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.512 HG22 HD22 ' A' ' 71' ' ' ASN . 18.8 p -52.26 110.68 0.52 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.467 0.576 . . . . 0.0 112.16 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 35.8 mt-10 -55.15 -23.95 23.99 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.715 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.403 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 5.2 mtpm? -42.39 -62.45 0.96 Allowed 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.006 176.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -56.67 -55.46 33.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.195 -172.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.496 HG22 ' HA ' ' A' ' 102' ' ' SER . 11.5 t -63.6 -46.18 86.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.694 -173.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -61.05 -49.35 77.72 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.886 0.375 . . . . 0.0 110.182 -177.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -62.62 -52.79 61.97 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.475 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.608 HG22 HG13 ' A' ' 68' ' ' VAL . 10.9 tp -67.16 -41.73 87.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.228 -174.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.9 m -66.53 -31.04 71.5 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.673 0.273 . . . . 0.0 110.536 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -63.64 -46.52 85.32 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.8 mt -59.66 -37.5 78.91 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.35 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.524 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 48.6 m0 -64.4 -44.35 91.56 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.484 177.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.51 -59.53 4.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.57 -62.16 4.2 Favored Glycine 0 CA--C 1.522 0.477 0 CA-C-N 115.806 -0.633 . . . . 0.0 113.139 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.1 m -58.84 -57.34 13.47 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.36 -46.69 89.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.929 0.395 . . . . 0.0 111.458 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -72.35 -27.84 62.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.125 -177.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -75.7 -28.19 58.53 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 110.064 177.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 3.63 51.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.287 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.3 t30 62.76 75.94 0.38 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.672 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.408 ' C ' ' H ' ' A' ' 95' ' ' VAL . 3.8 m-85 -107.67 122.17 46.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.086 169.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -81.24 26.49 0.45 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.227 0.537 . . . . 0.0 110.617 -176.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.408 ' H ' ' C ' ' A' ' 93' ' ' TYR . 11.1 m -92.05 157.44 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.906 -173.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -112.85 154.97 25.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.95 138.15 24.05 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -122.11 151.5 40.85 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.867 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -121.14 90.2 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.636 0.731 . . . . 0.0 110.697 -175.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.9 p -128.82 129.64 68.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 174.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.407 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 80.67 101.32 0.32 Allowed Glycine 0 C--O 1.226 -0.378 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -170.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.496 ' HA ' HG22 ' A' ' 77' ' ' THR . 15.3 m -62.55 -9.11 7.67 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -169.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.597 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 16.1 p-10 -96.42 -18.98 19.52 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 122.113 -0.367 . . . . 0.0 111.335 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.484 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 49.9 ttt180 -137.88 132.27 32.24 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.983 -172.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.22 153.51 22.04 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.407 HG23 ' HE2' ' A' ' 108' ' ' MET . 11.3 tt -124.93 136.27 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 120.844 0.354 . . . . 0.0 111.269 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.409 ' HB2' ' HB2' ' A' ' 64' ' ' MET . 13.4 m-85 -117.96 139.02 51.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.751 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.809 ' HG3' ' HE2' ' A' ' 63' ' ' MET . 1.5 mpt? -109.96 115.92 30.67 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.604 178.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.533 HD12 HD21 ' A' ' 62' ' ' LEU . 15.4 mt -126.23 103.4 7.66 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.495 0.497 . . . . 0.0 111.502 -174.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mtp-105 -99.26 5.61 46.57 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 122.076 0.941 . . . . 0.0 108.502 165.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -146.85 124.09 11.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.026 -1.443 . . . . 0.0 107.674 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.63 57.17 0.25 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 119.805 -1.188 . . . . 0.0 113.808 -173.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.4 t -66.36 -25.97 67.05 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -96.79 24.02 6.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.373 177.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.32 -49.94 72.86 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.204 0.526 . . . . 0.0 111.321 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . 0.514 ' HH2' HD12 ' A' ' 133' ' ' LEU . 0.6 OUTLIER -76.62 -26.88 55.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.762 -179.208 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.06 -48.73 75.1 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 120.886 0.374 . . . . 0.0 110.297 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.605 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 15.0 tt -67.33 -39.02 81.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 177.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -55.13 -46.6 75.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.457 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.505 ' HA ' HG22 ' A' ' 123' ' ' VAL . 37.5 m-20 -61.95 -41.37 97.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.471 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -59.66 -38.44 81.46 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.099 0.476 . . . . 0.0 110.399 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 70.9 mt -69.82 -47.81 61.39 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.505 HG22 ' HA ' ' A' ' 120' ' ' ASP . 24.9 m -73.28 -18.72 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.718 0.294 . . . . 0.0 111.476 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 24.7 t -71.53 0.91 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.498 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.524 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 45.8 mt-30 -76.87 162.85 27.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.74 0.781 . . . . 0.0 112.715 -174.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.65 8.79 1.3 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.345 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.42 ' H ' ' C ' ' A' ' 125' ' ' GLN . 80.9 mtt-85 -121.14 -18.26 7.5 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 122.373 0.269 . . . . 0.0 110.882 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 52.9 t 57.59 71.75 0.56 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.357 0.599 . . . . 0.0 109.984 -172.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.52 130.21 39.6 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.028 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.464 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 42.7 mt-10 -81.26 114.04 19.79 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.252 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.3 t -95.53 128.08 47.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.5 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 33.8 p -133.08 145.28 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.707 HD11 ' HA ' ' A' ' 137' ' ' MET . 60.7 mt -102.13 168.87 9.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 110.978 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.546 ' HA ' ' HE2' ' A' ' 65' ' ' PHE . 36.1 tt0 -55.13 98.77 0.02 OUTLIER 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.141 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.81 -61.35 4.05 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.587 177.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -143.33 147.11 34.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.738 0.304 . . . . 0.0 110.681 -175.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.707 ' HA ' HD11 ' A' ' 133' ' ' LEU . 83.0 mtp -76.5 110.42 11.03 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 172.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.583 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 42.8 p90 -59.63 -33.29 15.43 Favored Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -175.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.583 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 33.8 Cg_endo -66.04 -24.59 52.3 Favored 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 121.222 1.281 . . . . 0.0 112.072 174.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 82.85 -66.25 3.97 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.369 -177.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 C--O 1.235 0.319 0 C-N-CA 122.41 0.284 . . . . 0.0 110.672 -175.44 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.769 ' HB3' ' HG3' ' A' ' 4' ' ' ARG . 1.3 m-20 -101.0 151.79 21.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.993 0.425 . . . . 0.0 110.842 -176.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.473 HD11 ' HA2' ' A' ' 101' ' ' GLY . 12.8 tt -96.85 15.7 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 121.579 0.704 . . . . 0.0 109.988 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.769 ' HG3' ' HB3' ' A' ' 2' ' ' ASP . 92.8 mtt180 -57.96 -31.61 67.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.009 -176.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.45 -50.34 71.97 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.976 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.02 -47.17 86.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.993 176.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.581 ' O ' ' HB2' ' A' ' 11' ' ' MET . 91.7 m-20 -52.34 -74.93 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.961 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -51.65 -66.34 0.4 Allowed 'General case' 0 C--O 1.24 0.595 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -57.34 8.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.885 -169.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -76.26 -37.76 57.15 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.111 -168.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.64 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 11.1 mmt -67.79 -40.86 83.88 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 120.156 -0.618 . . . . 0.0 109.728 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.9 -52.28 66.14 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 121.212 0.53 . . . . 0.0 110.158 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.42 -32.37 73.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.858 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.7 tp -77.38 -52.52 9.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.819 0.343 . . . . 0.0 110.801 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 11' ' ' MET . 3.5 mm? -77.05 -10.23 59.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.995 -177.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -47.98 -53.78 15.0 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.996 175.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.18 -37.73 88.53 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.254 -177.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -61.22 -42.17 98.13 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.028 0.442 . . . . 0.0 110.764 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -69.52 -41.24 76.29 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.501 ' O ' HG13 ' A' ' 24' ' ' ILE . 59.1 tttp -54.15 -50.36 67.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.093 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.2 -54.39 47.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.01 178.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.95 -41.71 64.76 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.176 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -65.93 -44.97 83.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.644 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.4 mt -61.98 -34.69 64.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 120.856 0.36 . . . . 0.0 110.39 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -69.13 -38.74 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.308 177.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.49 -21.32 66.25 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.369 0.604 . . . . 0.0 109.658 170.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.98 17.78 46.22 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.304 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -113.8 109.14 18.07 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 176.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.444 HD12 HG12 ' A' ' 24' ' ' ILE . 3.8 mm? . . . . . 0 C--N 1.329 -0.298 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 175.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.676 HD23 ' HE2' ' A' ' 64' ' ' MET . 1.5 tm? . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 121.378 0.609 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.508 ' HE2' ' HG3' ' A' ' 134' ' ' GLU . 8.8 ptm -147.19 113.58 5.94 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.225 174.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.676 ' HE2' HD23 ' A' ' 62' ' ' LEU . 62.5 mtt -117.42 141.29 48.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.815 -170.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.47 ' HE2' ' HG2' ' A' ' 134' ' ' GLU . 51.9 m-85 -107.03 122.08 45.75 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 168.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 t -110.62 102.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 110.933 -174.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.708 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 37.1 m -77.15 100.34 5.72 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 172.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.452 HG11 HG22 ' A' ' 80' ' ' ILE . 50.4 t -80.34 -63.64 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.153 -171.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.531 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 38.7 t -93.24 -55.39 3.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.127 0.489 . . . . 0.0 112.233 -172.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.583 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 90.86 -10.27 75.39 Favored Glycine 0 N--CA 1.451 -0.329 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 -167.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.519 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 34.6 t30 -107.79 126.61 29.46 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 176.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.553 ' O ' ' HB2' ' A' ' 102' ' ' SER . 19.0 Cg_endo -56.62 -16.45 19.12 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.6 2.867 . . . . 0.0 114.42 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.638 HG23 ' HG3' ' A' ' 75' ' ' LYS . 2.1 m -61.66 95.61 0.05 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.291 0.567 . . . . 0.0 110.468 -177.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -44.94 -31.01 1.12 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.571 1.148 . . . . 0.0 113.918 -172.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.638 ' HG3' HG23 ' A' ' 73' ' ' THR . 0.0 OUTLIER -51.76 -34.61 40.2 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -175.598 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.608 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 5.6 mm-40 -58.23 -55.66 32.17 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.02 0.438 . . . . 0.0 111.023 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.6 m -65.21 -34.73 79.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.923 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.62 -51.65 68.48 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.722 0.296 . . . . 0.0 110.341 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 50.3 mt-10 -55.79 -54.11 48.47 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.33 0.586 . . . . 0.0 110.079 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.488 HD11 HD11 ' A' ' 83' ' ' LEU . 2.6 tp -62.15 -42.36 94.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.146 -172.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 72.6 m -64.67 -39.2 93.27 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.629 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.2 m -62.66 -40.28 96.56 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 120.838 0.351 . . . . 0.0 110.339 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.488 HD11 HD11 ' A' ' 80' ' ' ILE . 86.6 mt -60.89 -50.09 74.81 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.647 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.9 m0 -60.61 -31.7 70.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.036 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.57 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 35.3 tt0 -62.75 -63.36 1.24 Allowed 'General case' 0 C--O 1.235 0.327 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 173.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.49 -13.68 24.22 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.634 -0.712 . . . . 0.0 114.025 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -96.55 -71.36 0.68 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.376 0.588 . . . . 0.0 111.743 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.555 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 9.4 mp -56.42 -54.96 39.48 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.342 -174.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.57 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 91.8 m-85 -72.02 -14.32 61.85 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.358 -173.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -78.62 -32.7 47.58 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.46 11.74 22.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.672 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 72.65 25.7 2.56 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.359 0.664 . . . . 0.0 112.638 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.555 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 27.7 m-85 -81.99 81.77 7.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.64 82.49 3.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.239 0.542 . . . . 0.0 109.922 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.809 HG11 HD22 ' A' ' 109' ' ' LEU . 4.3 m -109.14 165.56 5.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.365 -177.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.445 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -101.5 136.54 41.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 174.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.612 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.33 142.22 23.83 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -172.805 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -127.27 127.74 44.86 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.6 tt -87.4 88.0 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 122.071 0.939 . . . . 0.0 109.125 173.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.78 134.58 38.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.119 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.473 ' HA2' HD11 ' A' ' 3' ' ' ILE . . . 100.4 104.7 2.67 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.553 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 11.1 p -38.23 -51.92 1.47 Allowed 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -173.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.583 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 10.1 p-10 -102.11 8.16 40.83 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.708 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 54.4 mtt180 -137.04 140.8 42.31 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.58 143.85 46.5 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.641 173.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.649 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.7 tt -112.34 139.56 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.741 0.305 . . . . 0.0 111.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -128.77 139.85 52.0 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.781 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.649 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.3 mpp? -135.14 143.19 46.4 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.049 0.452 . . . . 0.0 110.517 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.809 HD22 HG11 ' A' ' 95' ' ' VAL . 12.4 mt -138.44 151.98 47.92 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.366 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -85.35 -33.02 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.589 176.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -112.73 152.9 28.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.163 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -118.34 27.39 7.33 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 121.273 -0.489 . . . . 0.0 112.474 -178.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -66.02 -69.25 0.31 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.019 0.438 . . . . 0.0 110.693 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.02 25.71 1.1 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.329 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.76 92.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.824 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -77.52 -31.29 53.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.362 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -67.45 -50.84 57.44 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.215 177.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 7.6 tt -62.72 -37.9 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.344 -0.389 . . . . 0.0 109.985 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.565 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 12.2 tmtt? -56.48 -51.64 67.69 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.293 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.486 ' HA ' HG23 ' A' ' 123' ' ' VAL . 64.9 m-20 -62.15 -33.37 74.37 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.668 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -67.58 -42.79 81.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 94.5 mt -61.08 -41.65 97.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.486 HG23 ' HA ' ' A' ' 120' ' ' ASP . 20.6 m -79.06 -15.91 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.515 0.197 . . . . 0.0 111.246 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.5 t -64.87 2.17 0.76 Allowed 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.647 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -84.87 98.84 10.55 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.349 0.595 . . . . 0.0 110.174 -176.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -45.97 -51.24 13.73 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.467 -1.242 . . . . 0.0 113.582 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 30.9 mtm180 -55.79 -44.65 77.97 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.71 0.29 . . . . 0.0 111.482 -174.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.531 ' SG ' ' HA ' ' A' ' 69' ' ' SER . 21.5 p 177.07 136.0 0.06 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.779 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.511 ' HB3' ' HB2' ' A' ' 125' ' ' GLN . . . -170.93 116.98 0.46 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.75 0.309 . . . . 0.0 111.171 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -137.03 127.61 26.89 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 10.8 p -123.9 143.97 35.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 0.0 110.773 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 53.6 m -131.53 144.98 51.52 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 177.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.448 HD22 ' HG2' ' A' ' 64' ' ' MET . 64.1 mt -93.58 145.5 24.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.508 ' HG3' ' HE2' ' A' ' 63' ' ' MET . 0.2 OUTLIER -82.19 140.11 33.91 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.23 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.09 -108.14 3.53 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 -176.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -148.32 173.02 13.48 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.536 0.334 . . . . 0.0 110.361 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.595 ' HE1' ' HG2' ' A' ' 139' ' ' PRO . 14.0 tpt -72.61 106.0 4.47 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.497 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 90.4 m-85 -71.72 -52.46 8.12 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.595 ' HG2' ' HE1' ' A' ' 137' ' ' MET . 92.2 Cg_endo -80.56 124.1 5.08 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 121.872 1.714 . . . . 0.0 111.938 -178.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 90.23 102.4 1.16 Allowed Glycine 0 N--CA 1.451 -0.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.419 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.235 0.294 0 CA-C-O 120.826 0.346 . . . . 0.0 110.601 -179.922 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.94 0 N-CA-C 111.888 -0.485 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -141.61 -39.14 0.39 Allowed 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.985 0.421 . . . . 0.0 110.664 -175.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.603 HG23 ' HB3' ' A' ' 103' ' ' ASP . 12.1 tt -67.97 92.35 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.61 0.719 . . . . 0.0 110.657 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 60.7 mtt85 -109.58 -37.13 5.78 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.499 -175.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -56.31 -43.58 79.06 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.736 -178.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.445 ' HE1' HG11 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -55.21 -47.11 75.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.441 176.731 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.605 ' O ' ' HB2' ' A' ' 11' ' ' MET . 44.1 m-80 -60.88 -64.54 0.92 Allowed 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -50.36 -69.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.683 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.464 ' HB2' ' NH1' ' A' ' 13' ' ' ARG . . . -59.38 -64.4 0.96 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.042 -174.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.73 -46.49 65.81 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.863 -167.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.623 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 22.3 mmt -70.54 -38.51 74.22 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.938 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.32 -47.12 77.66 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.417 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.464 ' NH1' ' HB2' ' A' ' 9' ' ' ALA . 80.3 mtt180 -70.3 -26.79 63.95 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.885 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.6 tp -82.77 -52.28 6.9 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.907 176.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 4.1 mm? -73.1 -17.25 61.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.986 -174.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.5 OUTLIER -57.47 -32.97 67.5 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.102 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.96 -45.76 84.39 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.806 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -63.29 -41.21 98.96 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.912 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 46.5 mt-10 -63.02 -43.13 99.59 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.394 0.616 . . . . 0.0 109.381 176.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 24' ' ' ILE . 26.4 ttpt -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.12 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -59.07 -44.93 91.92 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.319 0.58 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.5 -37.24 86.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.32 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.33 -37.53 80.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.945 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 20' ' ' LYS . 85.8 mt -62.17 -38.53 81.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 174.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.87 -36.34 82.97 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.898 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -63.02 -15.07 55.17 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.738 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.99 24.77 26.4 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.682 177.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -134.7 132.0 38.33 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.574 -179.482 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 C--O 1.235 0.302 0 CA-C-O 121.208 0.528 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 21.4 ptm -132.03 110.23 10.58 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.666 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 56.8 mtt -114.73 122.15 45.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.721 -169.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -88.38 117.83 27.57 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 168.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.501 HG23 HD12 ' A' ' 122' ' ' LEU . 39.5 t -114.43 104.75 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.588 0.232 . . . . 0.0 110.954 -173.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.716 HG23 ' HB2' ' A' ' 130' ' ' GLU . 1.6 t -84.96 122.37 29.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -85.35 -61.58 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.302 -174.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 30.9 t -92.88 -36.38 12.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.145 0.498 . . . . 0.0 111.127 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.94 7.52 77.61 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -168.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.457 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 7.7 t30 -126.63 139.98 36.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 114.66 -0.77 . . . . 0.0 109.802 -176.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -47.51 -16.23 0.41 Allowed 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.632 3.555 . . . . 0.0 116.586 -174.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.457 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 5.5 p -76.73 160.28 29.46 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.501 1.046 . . . . 0.0 110.869 -169.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.576 ' HG2' ' HG3' ' A' ' 78' ' ' GLU . 37.5 tt0 -104.08 -25.38 12.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.646 -166.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.667 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.58 -52.74 53.75 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.678 -171.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.407 ' CD ' ' HG1' ' A' ' 73' ' ' THR . 1.8 pm0 -45.37 -58.89 2.99 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.283 175.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.44 ' HA ' HG22 ' A' ' 80' ' ' ILE . 35.5 m -67.13 -35.97 80.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.856 -174.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.576 ' HG3' ' HG2' ' A' ' 74' ' ' GLU . 49.1 mt-10 -56.05 -60.17 3.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.09 176.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.422 ' O ' HD12 ' A' ' 83' ' ' LEU . 44.0 mt-10 -59.08 -54.02 51.82 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.899 -175.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.808 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.9 tp -62.36 -42.76 96.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.938 -174.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 91.7 m -64.0 -33.18 75.15 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.457 0.17 . . . . 0.0 111.063 176.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.1 m -63.04 -39.07 93.65 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 110.294 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 79' ' ' GLU . 10.4 mp -67.75 -48.28 66.86 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.539 174.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.672 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 43.7 m0 -55.87 -55.94 26.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.968 -179.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -57.33 -54.81 42.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.61 -29.16 3.93 Favored Glycine 0 C--N 1.333 0.393 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.273 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.6 m -91.79 -57.1 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 117.527 0.664 . . . . 0.0 111.284 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.88 -48.62 79.3 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.667 -174.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -74.31 -22.49 59.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.979 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -73.62 -29.41 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.15 0.5 51.51 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.128 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 66.43 36.59 5.06 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.193 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -81.47 119.75 24.13 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -84.75 49.94 1.81 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.245 0.545 . . . . 0.0 111.199 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.99 150.21 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -102.49 144.98 30.23 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.404 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -146.42 137.92 24.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.147 -177.117 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -127.45 123.14 35.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 175.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -93.74 88.12 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.997 0.903 . . . . 0.0 109.337 173.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.445 HG11 ' HE1' ' A' ' 6' ' ' TYR . 7.0 p -131.53 143.39 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.093 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.2 85.74 0.14 Allowed Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.9 m -30.21 -44.27 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -167.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.603 ' HB3' HG23 ' A' ' 3' ' ' ILE . 13.2 t70 -69.18 -32.81 72.38 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -172.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.46 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 93.0 mtt180 -122.46 134.17 54.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.296 0.57 . . . . 0.0 112.323 -171.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -102.65 132.68 48.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 170.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.533 HD12 ' SD ' ' A' ' 11' ' ' MET . 9.3 tt -104.65 129.68 56.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.041 0.448 . . . . 0.0 111.197 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -115.2 132.38 56.63 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.613 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -131.27 136.52 48.25 Favored 'General case' 0 C--O 1.244 0.798 0 CA-C-O 121.366 0.603 . . . . 0.0 110.993 177.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.472 HD23 HD11 ' A' ' 118' ' ' ILE . 4.6 mp -123.11 156.13 35.59 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.871 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -105.09 5.72 32.65 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -135.35 151.75 50.8 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.493 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -127.58 41.53 1.58 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.054 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.8 m -93.6 -65.53 0.99 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.055 0.455 . . . . 0.0 110.113 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.414 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 41.4 p90 -91.0 27.6 1.79 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.021 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.61 -48.1 73.4 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.74 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -30.88 69.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.202 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.414 ' HB3' ' O ' ' A' ' 114' ' ' TYR . 5.1 tp10 -52.91 -49.71 65.39 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 172.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.602 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 25.1 mt -64.46 -45.41 95.86 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.126 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -58.17 7.32 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.317 0.58 . . . . 0.0 110.072 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.493 ' O ' ' HB2' ' A' ' 124' ' ' SER . 11.2 m-20 -61.38 -36.85 81.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.791 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -63.36 -47.16 83.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.738 0.304 . . . . 0.0 110.381 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.5 mt -57.81 -45.9 85.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.815 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.504 HG11 ' O ' ' A' ' 129' ' ' ALA . 13.1 m -84.97 -6.75 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -177.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.493 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 23.2 t -68.65 0.99 3.54 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.808 ' HG2' HD11 ' A' ' 80' ' ' ILE . 2.9 mp0 -96.04 155.7 16.65 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.602 -0.686 . . . . 0.0 110.633 -174.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -51.59 -51.68 53.56 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.873 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -67.18 -10.12 47.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.483 179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 63.4 m 66.08 -156.62 0.26 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.906 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' HG11 ' A' ' 123' ' ' VAL . . . 173.23 126.77 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.716 ' HB2' HG23 ' A' ' 67' ' ' THR . 46.0 mt-10 -96.97 113.66 25.21 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.339 0.59 . . . . 0.0 110.331 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.9 t -98.99 135.94 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.282 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.4 m -127.1 112.75 15.54 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.666 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.6 mp -89.95 128.03 36.15 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -95.32 103.99 15.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.866 0.365 . . . . 0.0 110.109 176.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 155.9 -150.29 21.6 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.769 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -88.47 123.23 32.79 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.963 0.411 . . . . 0.0 110.376 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.541 ' HA ' ' HE1' ' A' ' 137' ' ' MET . 0.1 OUTLIER -76.6 94.43 3.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.737 178.168 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.498 ' CG ' ' HD3' ' A' ' 139' ' ' PRO . 23.9 p90 -70.13 -30.91 2.1 Favored Pre-proline 0 CA--C 1.544 0.732 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.515 ' HD2' ' HG3' ' A' ' 137' ' ' MET . 21.2 Cg_exo -67.61 78.99 0.49 Allowed 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 121.582 1.522 . . . . 0.0 111.363 172.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 157.17 -172.11 34.61 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.858 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 95.7 mttt . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.82 0.343 . . . . 0.0 110.663 -179.139 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -110.08 153.7 24.29 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.852 0.358 . . . . 0.0 110.614 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.4 tt -111.5 0.37 9.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 173.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -52.25 -36.41 52.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.304 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.6 -49.9 75.8 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.008 0.433 . . . . 0.0 110.4 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.4 -48.09 76.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.662 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.08 -62.01 1.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.635 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -57.71 -56.91 15.77 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.281 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.93 -61.48 2.58 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.586 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.91 -54.87 41.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.162 -174.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.572 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 6.2 mmt -58.01 -52.39 65.72 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-O 120.599 0.238 . . . . 0.0 110.904 -176.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.55 -50.18 74.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.019 0.438 . . . . 0.0 111.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -77.41 -12.11 59.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.142 -0.481 . . . . 0.0 112.095 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.2 tp -79.96 -52.15 8.2 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.387 0.613 . . . . 0.0 109.572 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.46 HD21 ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.7 -15.31 62.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.72 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.49 -43.41 45.26 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.572 0.701 . . . . 0.0 109.724 171.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.76 -45.65 93.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.454 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.438 ' CZ3' ' HG3' ' A' ' 108' ' ' MET . 28.4 m95 -62.26 -37.43 85.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -60.49 -43.5 96.94 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.053 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.9 tttt -61.43 -50.76 71.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.458 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.11 -46.71 79.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.792 0.329 . . . . 0.0 111.469 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -57.44 -48.69 78.48 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.369 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 28.9 t70 -71.62 -28.88 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 20' ' ' LYS . 50.4 mt -64.42 -42.51 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -69.98 -26.95 64.33 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.03 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.408 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 8.4 tp10 -60.44 -18.32 50.3 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.642 0.734 . . . . 0.0 109.264 169.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.14 35.26 6.38 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.84 172.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -156.48 141.84 17.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 7.0 mp . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.492 179.654 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.676 HD12 ' HE2' ' A' ' 64' ' ' MET . 2.0 tm? . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 121.238 0.542 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.746 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 28.9 mtp -138.74 132.17 30.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.676 ' HE2' HD12 ' A' ' 62' ' ' LEU . 63.4 mtt -116.88 125.21 51.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.225 0.536 . . . . 0.0 112.147 -170.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.574 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 72.2 m-85 -95.17 121.63 37.01 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 168.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.479 HG21 HD12 ' A' ' 122' ' ' LEU . 40.6 t -117.02 105.59 18.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.755 0.312 . . . . 0.0 110.614 -174.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.2 m -79.37 98.42 6.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.479 HG12 HG22 ' A' ' 80' ' ' ILE . 25.2 t -79.64 -60.33 2.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.727 -172.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.447 ' OG ' ' HB3' ' A' ' 71' ' ' ASN . 39.9 t -92.62 -57.03 2.8 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.015 -173.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.701 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 82.12 11.52 82.29 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 -167.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.538 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 8.4 t30 -125.99 136.07 27.96 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 123.15 0.58 . . . . 0.0 109.709 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -59.99 -16.89 41.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.886 3.057 . . . . 0.0 116.382 -168.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.538 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 2.7 p -69.65 172.18 7.85 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.27 0.941 . . . . 0.0 112.144 -173.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.91 -22.62 14.29 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.41 -167.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 10.8 mptt -60.65 -51.89 67.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.601 -170.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.528 ' HG2' ' H ' ' A' ' 77' ' ' THR . 1.6 pm0 -47.57 -62.58 1.37 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.721 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.528 ' H ' ' HG2' ' A' ' 76' ' ' GLU . 14.2 t -60.96 -43.9 98.06 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.48 0.181 . . . . 0.0 110.904 -174.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -57.4 -60.87 3.0 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.165 0.507 . . . . 0.0 110.881 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.491 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 37.6 mt-10 -67.73 -37.85 82.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.701 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.479 HG22 HG12 ' A' ' 68' ' ' VAL . 9.8 tp -70.09 -39.76 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.444 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.5 m -64.87 -38.03 89.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.608 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.4 p -67.47 -34.86 78.03 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.701 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 92.5 mt -64.6 -48.85 73.38 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.965 0.412 . . . . 0.0 110.074 174.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 m0 -58.18 -39.9 80.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.803 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -57.15 -58.82 6.54 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.57 -28.07 36.15 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 115.439 -0.8 . . . . 0.0 113.804 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.7 m -85.15 -69.3 0.66 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 117.395 0.597 . . . . 0.0 111.805 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.5 mp -59.95 -35.09 74.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -172.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -85.67 -2.58 58.33 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -103.85 -26.27 12.75 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 171.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.85 -11.25 59.94 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.308 0.575 . . . . 0.0 109.461 168.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 66.56 78.74 0.25 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.647 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -117.13 170.65 8.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.667 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -125.86 98.22 5.44 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.411 HG12 ' CD2' ' A' ' 109' ' ' LEU . 30.9 m -139.02 153.7 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.756 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.449 ' HB3' ' SD ' ' A' ' 108' ' ' MET . 6.6 tp60 -101.56 145.57 28.85 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 169.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.638 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -148.79 132.84 17.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.618 -169.771 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -129.96 132.88 46.47 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.141 175.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.496 HD12 HG23 ' A' ' 77' ' ' THR . 8.6 tt -91.31 89.03 2.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.704 0.764 . . . . 0.0 109.677 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.4 125.62 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.056 -178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 101.0 104.6 2.72 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -167.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.438 ' O ' ' HB ' ' A' ' 77' ' ' THR . 16.0 m -47.93 -34.03 8.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.575 0.584 . . . . 0.0 112.575 -175.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.701 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 7.1 p-10 -103.22 -4.19 24.69 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -135.67 136.34 40.85 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.919 0.39 . . . . 0.0 111.789 -164.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.2 154.68 30.71 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.003 175.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.7 tt -123.41 139.05 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.412 178.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -131.41 154.32 48.77 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.114 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.449 ' SD ' ' HB3' ' A' ' 96' ' ' GLN . 0.8 OUTLIER -148.38 135.32 20.07 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.357 0.599 . . . . 0.0 111.821 176.265 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.433 ' HB2' HD11 ' A' ' 62' ' ' LEU . 13.2 mt -108.93 109.33 20.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.589 174.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.72 -27.06 31.42 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 175.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -147.38 111.61 5.18 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.925 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.52 129.32 1.34 Allowed Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.756 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.3 m -95.25 -19.75 19.76 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 111.043 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -75.64 35.9 0.13 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.962 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.0 -56.44 21.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.877 -177.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . 0.401 ' HA ' ' HB3' ' A' ' 119' ' ' LYS . 0.7 OUTLIER -73.96 -14.42 61.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.522 -176.684 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -75.55 -52.47 10.55 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.499 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.9 tt -62.38 -39.35 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.496 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 51.9 tttm -54.71 -51.67 64.86 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.511 174.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.49 -43.86 76.0 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.561 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -66.74 -39.76 88.06 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 98.7 mt -65.5 -39.97 92.5 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.046 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.451 ' C ' ' H ' ' A' ' 125' ' ' GLN . 30.0 m -89.41 -2.66 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 120.821 0.343 . . . . 0.0 111.081 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.2 t -61.99 2.16 0.24 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' A' ' 123' ' ' VAL . 72.6 mt-30 -87.3 104.25 16.23 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.429 0.633 . . . . 0.0 110.347 -174.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -48.31 -44.81 34.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.328 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -69.23 -44.82 71.23 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.437 ' SG ' ' N ' ' A' ' 129' ' ' ALA . 23.5 t -166.75 -152.95 0.14 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.631 -171.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.437 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . 84.25 109.23 0.06 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.048 0.939 . . . . 0.0 111.921 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -124.28 141.43 52.07 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.422 175.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 14.8 p -118.83 149.71 21.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.023 0.44 . . . . 0.0 111.474 -174.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.3 m -143.18 146.83 34.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.482 HD11 ' HA ' ' A' ' 137' ' ' MET . 86.4 mt -86.85 162.32 17.83 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.838 0.352 . . . . 0.0 111.222 -175.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.746 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 1.6 tm-20 -67.02 130.4 43.01 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.893 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.97 -77.29 1.82 Allowed Glycine 0 N--CA 1.449 -0.481 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.026 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -151.46 146.38 25.88 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 122.732 0.413 . . . . 0.0 110.272 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.482 ' HA ' HD11 ' A' ' 133' ' ' LEU . 69.9 mtp -78.21 112.79 15.54 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 171.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -55.34 -48.95 95.08 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.334 -174.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.08 -1.72 11.91 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 121.78 1.653 . . . . 0.0 112.595 177.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 93.27 163.42 36.93 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 -174.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 117.01 0.405 . . . . 0.0 110.186 178.693 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 112.431 -0.267 . . . . 0.0 112.431 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 58.8 23.38 11.17 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.258 0.551 . . . . 0.0 110.619 -177.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 50.6 mm -65.38 -43.46 94.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.632 -178.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.3 mtm105 -61.15 -50.16 74.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.506 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.98 -49.76 74.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.336 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -58.78 -46.92 86.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.15 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.433 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.2 m-80 -53.19 -71.56 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.173 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -53.6 -61.86 2.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.197 -176.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.4 -63.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.663 -172.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.58 -43.53 89.46 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.795 -170.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.523 ' HE1' HG11 ' A' ' 100' ' ' VAL . 35.3 mtp -72.88 -32.5 65.43 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.055 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.32 88.99 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 172.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 94.7 mtt180 -69.23 -18.85 63.93 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.881 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 66.2 tp -79.52 -52.84 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 110.168 175.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.406 ' CD1' ' HE2' ' A' ' 63' ' ' MET . 3.9 mm? -71.95 -9.37 58.26 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.781 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -48.25 -40.48 24.76 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.64 0.733 . . . . 0.0 109.159 168.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.43 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 51.2 tp60 -61.49 -50.06 74.25 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.442 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.42 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 13.8 m95 -59.73 -35.13 73.93 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.485 -177.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -60.95 -46.19 91.71 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -59.08 -44.17 91.88 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.976 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -59.32 -55.09 39.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.718 0.294 . . . . 0.0 110.632 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.2 -37.72 78.13 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.92 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.08 -50.43 73.3 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.59 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.497 HG12 HD12 ' A' ' 29' ' ' LEU . 77.2 mt -58.57 -39.46 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-O 121.134 0.493 . . . . 0.0 110.248 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.7 -35.15 79.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -78.41 -1.21 32.43 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.13 27.46 37.02 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.38 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -126.75 109.94 12.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.617 0.246 . . . . 0.0 110.392 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.497 HD12 HG12 ' A' ' 24' ' ' ILE . 3.5 mm? . . . . . 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.7 tt . . . . . 0 C--O 1.238 0.474 0 CA-C-O 121.841 0.829 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.749 ' HE3' ' HG3' ' A' ' 108' ' ' MET . 67.4 mtp -141.02 144.33 34.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.631 172.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.2 mtt -118.42 122.43 42.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.86 0.362 . . . . 0.0 111.385 -176.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.499 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 52.2 m-85 -98.47 95.38 7.28 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.9 t -87.83 146.43 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 122.244 -0.285 . . . . 0.0 110.327 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.457 ' HB ' ' NH2' ' A' ' 104' ' ' ARG . 7.2 t -125.26 110.37 13.96 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 174.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.51 HG12 HG23 ' A' ' 80' ' ' ILE . 21.4 t -98.44 -60.94 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.355 -169.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -83.34 -50.08 8.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.862 -170.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.8 20.34 74.2 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -168.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -126.35 136.97 29.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 114.743 -0.729 . . . . 0.0 109.125 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -64.05 -15.79 51.26 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.32 2.68 . . . . 0.0 114.693 -172.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.596 HG23 ' HD3' ' A' ' 75' ' ' LYS . 17.1 m -75.76 119.97 20.5 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.555 0.693 . . . . 0.0 111.26 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -55.58 -23.62 28.18 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.528 0.731 . . . . 0.0 111.557 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.596 ' HD3' HG23 ' A' ' 73' ' ' THR . 11.0 mptt -62.2 -62.83 1.49 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.705 -169.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.433 ' OE1' ' HB ' ' A' ' 73' ' ' THR . 13.8 pm0 -65.95 -37.15 85.27 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.543 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.503 HG23 HD11 ' A' ' 99' ' ' ILE . 12.2 t -68.3 -38.79 82.0 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.638 0.256 . . . . 0.0 110.312 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.83 -46.62 89.84 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.447 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 45.7 mt-10 -56.18 -54.24 47.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.134 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.586 HD13 HD12 ' A' ' 83' ' ' LEU . 11.1 tp -63.19 -43.14 98.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-O 120.946 0.403 . . . . 0.0 111.006 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.8 m -66.69 -30.7 71.02 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.065 0.46 . . . . 0.0 110.21 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.7 t -70.68 -33.9 71.4 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.699 177.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.586 HD12 HD13 ' A' ' 80' ' ' ILE . 88.0 mt -63.52 -45.16 91.91 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.254 0.549 . . . . 0.0 109.705 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.646 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.1 m0 -60.85 -44.66 96.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.948 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -57.84 -38.64 76.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.234 0.54 . . . . 0.0 109.982 172.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.18 -31.35 77.28 Favored Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.737 -178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.4 m -95.99 -60.36 1.65 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.77 -48.05 80.77 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -69.95 -32.7 71.08 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.739 0.304 . . . . 0.0 110.892 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -67.66 -28.22 67.52 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.237 0.541 . . . . 0.0 109.705 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.85 8.73 11.6 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.366 175.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 68.13 30.17 5.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.094 174.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -89.45 108.36 19.6 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 173.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -80.47 62.74 4.68 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.328 0.585 . . . . 0.0 110.623 178.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.5 m -90.45 167.75 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.113 176.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.732 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.8 tp60 -110.17 143.13 40.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.447 173.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.86 135.13 35.89 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.726 0.298 . . . . 0.0 110.539 -177.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -131.02 153.45 49.24 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.503 HD11 HG23 ' A' ' 77' ' ' THR . 9.4 tt -130.71 90.04 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.68 0.752 . . . . 0.0 110.745 -179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.523 HG11 ' HE1' ' A' ' 11' ' ' MET . 6.2 p -130.57 128.24 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 173.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.9 104.01 2.67 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -167.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -46.68 -25.63 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 67' ' ' THR . 12.1 p-10 -100.67 -27.73 13.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.319 0.58 . . . . 0.0 110.209 178.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.471 ' HG2' ' HE3' ' A' ' 11' ' ' MET . 0.2 OUTLIER -84.62 121.57 27.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.764 -171.322 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -116.42 132.42 56.68 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 13.0 tt -124.38 132.25 71.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-O 121.083 0.468 . . . . 0.0 111.44 -173.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -120.74 128.75 53.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.355 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.749 ' HG3' ' HE3' ' A' ' 63' ' ' MET . 1.8 mpt? -99.16 122.33 42.22 Favored 'General case' 0 C--O 1.247 0.971 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.347 177.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.433 HD23 ' N ' ' A' ' 109' ' ' LEU . 2.4 mm? -117.64 121.66 41.48 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 123.839 0.712 . . . . 0.0 109.264 174.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.7 mmm-85 -67.89 -49.11 63.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -128.27 110.99 12.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.769 172.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -89.86 47.01 3.15 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.616 -175.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.2 m -59.56 -39.69 84.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.269 0.557 . . . . 0.0 110.481 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 22.0 p90 -98.34 23.32 8.53 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.154 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.54 97.39 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.509 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -67.71 -34.05 76.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.353 -176.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -59.55 -43.58 93.5 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.102 0.477 . . . . 0.0 109.91 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.546 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -65.39 -42.22 93.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.481 176.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -53.72 -52.06 61.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.225 0.536 . . . . 0.0 110.182 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.439 ' HA ' HG21 ' A' ' 123' ' ' VAL . 1.7 m-20 -62.04 -38.1 87.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.635 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -61.86 -53.68 52.55 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.722 0.296 . . . . 0.0 110.464 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 76.0 mt -50.65 -47.69 58.49 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.419 177.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.439 HG21 ' HA ' ' A' ' 120' ' ' ASP . 19.8 m -80.22 -13.34 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.583 0.23 . . . . 0.0 111.412 -177.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.1 t -73.9 -0.78 17.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.957 0.408 . . . . 0.0 110.558 175.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.646 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 21.3 mt-30 -84.13 165.24 18.63 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -78.79 -47.1 17.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.776 -167.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -86.89 -20.68 27.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.094 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 57.6 m 67.37 175.36 0.26 Allowed 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.433 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -161.24 156.46 24.18 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.96 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -99.74 157.1 16.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.246 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.69 151.66 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.139 0.495 . . . . 0.0 111.221 -174.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.499 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 59.8 m -124.87 134.49 52.68 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.628 HD13 ' SD ' ' A' ' 137' ' ' MET . 88.9 mt -96.5 142.75 28.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.329 -175.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -84.09 132.67 34.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.963 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.59 -86.94 1.14 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.174 -0.467 . . . . 0.0 112.219 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -141.43 151.47 43.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.684 0.278 . . . . 0.0 110.422 -176.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.628 ' SD ' HD13 ' A' ' 133' ' ' LEU . 15.1 tpt -72.41 94.67 1.67 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 175.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.507 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 11.4 m-85 -53.65 -50.87 81.02 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.29 -175.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.507 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 5.8 Cg_exo -81.51 31.92 0.52 Allowed 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 122.809 2.34 . . . . 0.0 112.549 179.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -163.15 68.79 0.22 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.005 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 95.5 mttt . . . . . 0 C--O 1.238 0.499 0 CA-C-O 120.882 0.372 . . . . 0.0 111.058 -177.587 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.875 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 t70 69.03 116.33 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.176 0.59 . . . . 0.0 112.427 177.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.2 tt -130.47 13.04 2.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 122.246 1.022 . . . . 0.0 108.408 171.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.448 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 18.4 ttp180 -63.06 -37.28 86.57 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.382 -1.281 . . . . 0.0 111.651 -175.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.19 -46.62 85.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.19 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.548 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.9 OUTLIER -54.32 -47.67 72.23 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 173.342 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.517 ' O ' ' HB2' ' A' ' 11' ' ' MET . 0.8 OUTLIER -50.63 -76.18 0.02 OUTLIER 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.735 -177.808 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -61.3 -61.94 2.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.14 -176.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.44 -50.64 70.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.949 -169.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.548 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 1.3 m-20 -78.48 -43.57 26.74 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.523 -172.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.651 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 8.9 mmt -63.12 -43.05 99.49 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.833 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.526 ' O ' ' HG3' ' A' ' 16' ' ' GLU . . . -64.51 -53.91 40.72 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.902 0.382 . . . . 0.0 110.327 177.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.1 ttp-105 -52.33 -38.75 59.42 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.946 -175.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.6 tp -84.88 -49.16 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.334 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.508 HD23 ' O ' ' A' ' 11' ' ' MET . 4.5 mm? -68.11 -21.43 64.95 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -172.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 29.8 mt-10 -55.64 -25.71 40.58 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.914 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.451 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 46.4 tt0 -63.08 -49.74 73.31 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 176.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -64.31 -35.29 80.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.161 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.98 -53.19 61.01 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.517 ' O ' HG13 ' A' ' 24' ' ' ILE . 20.1 ttpp -51.67 -43.11 62.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.791 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -62.21 -52.79 62.36 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.546 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -69.55 -28.24 65.83 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.4 -177.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -65.16 -45.78 83.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.1 0.476 . . . . 0.0 110.397 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 20' ' ' LYS . 68.6 mt -60.75 -43.91 96.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.341 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -66.14 -36.25 82.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -63.75 -26.25 68.56 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.413 0.625 . . . . 0.0 109.763 175.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.97 40.84 4.5 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.518 176.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -147.04 110.3 4.82 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 173.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.236 0.363 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.527 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 pp . . . . . 0 C--O 1.243 0.753 0 CA-C-O 122.402 1.096 . . . . 0.0 113.553 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 23.8 ptp -125.69 132.61 52.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 113.709 -1.587 . . . . 0.0 107.99 174.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.454 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 82.8 mtp -108.29 116.91 32.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 -174.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.43 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 56.5 m-85 -89.16 125.51 35.08 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.488 HG13 HD21 ' A' ' 122' ' ' LEU . 22.1 t -115.83 98.3 6.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.74 ' HB ' ' HB3' ' A' ' 130' ' ' GLU . 4.9 m -74.41 94.92 2.63 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 176.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 p -102.11 -47.1 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.096 -169.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 m -91.26 -49.23 6.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.883 0.373 . . . . 0.0 111.569 -172.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 66.99 10.96 57.56 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -170.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.413 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 33.2 t30 -127.2 125.72 24.11 Favored Pre-proline 0 CA--C 1.533 0.306 0 C-N-CA 123.229 0.612 . . . . 0.0 109.565 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 25.4 Cg_exo -61.94 -18.3 60.48 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.282 2.655 . . . . 0.0 113.503 -177.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.435 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 37.7 m -55.44 104.15 0.12 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.699 0.4 . . . . 0.0 111.073 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.485 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 42.1 mt-10 -50.05 -25.93 3.88 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.3 OUTLIER -58.49 -37.61 75.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.809 -177.113 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -57.74 -64.79 0.78 Allowed 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.639 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.456 ' HA ' HG21 ' A' ' 80' ' ' ILE . 12.6 t -62.3 -36.13 81.17 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.648 -177.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -53.47 -59.7 4.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.988 0.423 . . . . 0.0 110.922 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.78 -45.74 74.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.373 -175.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.456 HG21 ' HA ' ' A' ' 77' ' ' THR . 10.8 tp -66.92 -42.02 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.164 -175.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 67.8 m -69.86 -33.15 71.87 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.638 0.256 . . . . 0.0 110.447 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.6 t -59.33 -47.53 85.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.114 0.483 . . . . 0.0 109.719 175.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.8 mt -59.78 -48.19 82.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.053 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.545 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 44.1 m0 -58.69 -32.74 69.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.032 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.613 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 29.6 tt0 -66.1 -62.77 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.403 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -57.69 -18.12 30.19 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.791 -0.64 . . . . 0.0 114.143 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.3 m -95.88 -65.28 0.98 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 117.498 0.649 . . . . 0.0 111.574 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.33 -52.31 54.76 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.83 0.348 . . . . 0.0 111.34 -173.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.613 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 98.1 m-85 -72.27 -9.13 58.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 0.0 111.156 -176.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 39.2 t30 -72.81 -26.81 61.64 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.51 14.32 17.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.759 177.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 60.11 77.35 0.32 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.037 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -107.33 119.14 38.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.548 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -78.09 69.35 4.29 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.691 0.757 . . . . 0.0 109.768 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.528 HG23 HD11 ' A' ' 109' ' ' LEU . 57.7 t -126.02 136.79 59.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.586 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -101.6 115.46 30.57 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.502 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -107.49 131.93 53.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.243 -175.21 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.514 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.5 m-30 -110.55 131.09 55.35 Favored 'General case' 0 C--O 1.247 0.962 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.4 tt -111.38 89.69 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.991 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.44 144.39 17.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.68 82.51 0.23 Allowed Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.966 -1.254 . . . . 0.0 109.966 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.485 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 12.6 m -50.13 -23.6 2.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -168.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -61.0 -25.07 66.62 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.678 0.275 . . . . 0.0 110.828 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -145.49 159.62 42.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.612 0.72 . . . . 0.0 112.398 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -122.64 139.54 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.857 -1.065 . . . . 0.0 108.326 168.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.514 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 5.1 tt -110.12 126.3 67.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.588 -177.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.457 ' HB3' HG11 ' A' ' 95' ' ' VAL . 96.8 m-85 -112.25 112.1 23.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.185 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.506 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 68.5 mtm -90.93 122.43 33.61 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.528 HD11 HG23 ' A' ' 95' ' ' VAL . 4.0 mm? -87.61 103.92 16.02 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 123.513 0.508 . . . . 0.0 110.718 -175.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.6 -28.95 56.34 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 172.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -135.2 116.27 14.27 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.677 -1.147 . . . . 0.0 108.644 172.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -103.92 16.52 50.56 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.223 -0.513 . . . . 0.0 114.038 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -60.5 -20.39 59.98 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 117.207 0.504 . . . . 0.0 111.373 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -120.0 24.73 10.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.071 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.87 87.65 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.435 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -79.92 -27.01 39.92 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.02 -178.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.15 -50.47 70.3 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.0 tt -64.68 -41.47 92.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.129 176.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.442 ' HG3' HG11 ' A' ' 131' ' ' VAL . 86.7 tttt -54.83 -53.01 60.78 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.816 0.341 . . . . 0.0 110.943 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.498 ' HA ' HG23 ' A' ' 123' ' ' VAL . 20.0 m-20 -61.08 -39.14 88.79 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.584 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.432 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 89.7 t80 -60.31 -39.96 88.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.924 0.392 . . . . 0.0 109.988 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.2 mt -66.55 -41.01 89.33 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.375 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.498 HG23 ' HA ' ' A' ' 120' ' ' ASP . 18.7 m -75.61 -19.08 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.728 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 54.1 m -82.33 0.05 43.46 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.329 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.545 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 15.1 mm100 -73.77 162.87 28.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.897 0.38 . . . . 0.0 111.036 -177.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -54.31 -64.4 0.84 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.373 -174.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 127' ' ' ARG . 40.7 mtt180 -65.2 -7.6 13.54 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 44.0 t 57.25 79.24 0.2 Allowed 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -172.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.41 140.77 57.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 -171.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.74 ' HB3' ' HB ' ' A' ' 67' ' ' THR . 39.8 tt0 -79.12 118.39 21.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.727 177.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.442 HG11 ' HG3' ' A' ' 119' ' ' LYS . 48.1 t -101.55 130.14 51.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.47 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.43 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 20.7 p -135.86 129.33 32.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.454 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.1 mp -112.43 127.23 55.97 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -120.71 150.31 41.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.972 177.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 129.17 -96.79 0.4 Allowed Glycine 0 N--CA 1.453 -0.192 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -125.51 104.85 8.64 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 174.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.569 ' HA ' ' HE3' ' A' ' 137' ' ' MET . 0.1 OUTLIER -81.19 84.32 6.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.996 0.427 . . . . 0.0 110.077 -179.01 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.476 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 40.6 p90 -76.22 -32.78 1.15 Allowed Pre-proline 0 CA--C 1.545 0.776 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.476 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 5.6 Cg_exo -77.93 119.44 4.72 Favored 'Trans proline' 0 C--N 1.365 1.402 0 C-N-CA 121.8 1.667 . . . . 0.0 112.115 -178.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 69.01 -119.8 10.0 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.344 -0.455 . . . . 0.0 112.495 178.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 97.2 mttt . . . . . 0 C--O 1.237 0.404 0 C-N-CA 122.393 0.277 . . . . 0.0 110.632 -178.189 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.997 0 N-CA-C 111.921 -0.472 . . . . 0.0 111.921 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -91.57 39.04 0.99 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -172.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.416 HG12 ' HD2' ' A' ' 6' ' ' TYR . 15.3 tt -77.43 52.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-O 122.268 1.032 . . . . 0.0 108.592 172.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -71.62 -42.1 68.05 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -163.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -51.74 -50.13 61.2 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.886 0.374 . . . . 0.0 110.981 -172.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.465 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -63.29 -41.32 98.96 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.95 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.63 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 14.4 m-80 -55.7 -72.14 0.08 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.05 -63.06 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.344 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.13 -66.29 0.56 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.648 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -69.5 -43.85 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.928 -169.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.63 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 1.3 mmt -70.68 -45.27 65.35 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.778 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.25 97.49 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.511 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -81.24 -12.84 59.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.531 -177.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.511 ' HG ' HD21 ' A' ' 15' ' ' LEU . 5.5 tp -82.17 -54.33 5.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.026 0.441 . . . . 0.0 110.089 169.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.528 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 4.4 mm? -65.59 -25.55 67.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.92 -177.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -51.78 -42.18 62.21 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.325 0.584 . . . . 0.0 109.967 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.55 -48.82 79.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.273 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.491 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 43.6 m95 -58.32 -40.05 81.02 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.877 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.528 ' HG2' ' O ' ' A' ' 15' ' ' LEU . 41.7 mm-40 -61.36 -49.56 76.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.787 178.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.481 ' O ' HG13 ' A' ' 24' ' ' ILE . 78.9 tttt -60.61 -38.45 84.73 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.937 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -43.1 98.26 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -63.06 -39.82 95.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.303 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -61.43 -45.43 94.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.863 0.364 . . . . 0.0 110.496 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.4 mt -61.35 -36.4 72.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.442 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.1 -45.01 74.92 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -66.9 -17.91 65.13 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.988 176.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.84 48.83 3.29 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.441 173.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -150.29 128.92 12.3 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.402 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.532 0.272 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.157 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.508 HD13 ' HE1' ' A' ' 64' ' ' MET . 0.5 OUTLIER . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 110.467 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.659 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 15.6 ptm -144.47 112.4 6.3 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.928 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.508 ' HE1' HD13 ' A' ' 62' ' ' LEU . 65.7 mtt -114.22 122.82 47.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.412 -175.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -93.93 111.14 22.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 171.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.411 HG21 HG13 ' A' ' 131' ' ' VAL . 30.0 t -112.14 112.29 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 122.241 -0.287 . . . . 0.0 110.96 -172.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.597 HG21 ' HB2' ' A' ' 130' ' ' GLU . 3.8 t -87.56 107.07 18.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.3 m -101.79 -40.04 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.037 -171.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 36.7 t -86.9 -55.54 3.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.482 -172.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.647 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 78.38 -4.92 57.78 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.525 -171.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -125.87 132.78 24.42 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 123.323 0.649 . . . . 0.0 109.416 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.63 ' O ' ' HB3' ' A' ' 102' ' ' SER . 35.1 Cg_endo -60.13 -16.37 39.45 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.375 2.717 . . . . 0.0 114.389 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.414 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 23.7 m -60.96 100.17 0.11 Allowed 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.933 -0.48 . . . . 0.0 110.116 173.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -57.11 -23.21 45.43 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.404 -174.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.499 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -55.46 -34.73 64.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.361 -173.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.402 ' O ' HD13 ' A' ' 80' ' ' ILE . 34.9 mm-40 -59.26 -50.9 72.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.314 0.578 . . . . 0.0 109.484 176.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.8 m -67.83 -29.73 68.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.815 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.36 -49.86 72.2 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -59.76 -48.37 81.96 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 110.059 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.444 HG13 ' NE2' ' A' ' 125' ' ' GLN . 1.5 mp -53.72 -54.06 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.062 178.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.0 m -62.82 -35.45 79.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.076 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.6 t -63.7 -57.34 10.3 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.925 0.393 . . . . 0.0 110.635 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.86 -44.23 97.24 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.811 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.508 ' CZ3' HD21 ' A' ' 122' ' ' LEU . 45.3 m0 -63.89 -38.73 92.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.532 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -59.91 -60.98 2.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.17 -52.17 13.25 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.968 177.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.1 m -59.3 -54.78 42.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.777 0.323 . . . . 0.0 111.686 -176.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.447 HD11 ' O ' ' A' ' 84' ' ' TRP . 9.7 mp -69.28 -29.15 66.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.405 -175.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -75.66 -30.61 59.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.6 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.35 -30.99 70.94 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.71 4.57 36.07 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.384 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.8 t30 60.91 66.19 0.93 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.146 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -115.57 101.29 8.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.57 173.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.74 73.66 1.54 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.501 0.667 . . . . 0.0 110.621 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.2 m -87.98 157.21 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.528 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.491 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.9 tp60 -110.94 100.93 9.55 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.569 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.3 OUTLIER -109.8 138.81 45.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.575 -174.008 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.402 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 68.3 m-85 -134.98 128.52 32.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.26 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.5 tt -87.87 87.57 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-O 121.926 0.87 . . . . 0.0 108.918 169.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 p -132.35 121.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.465 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 100.8 102.74 2.56 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 -163.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.63 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 41.0 m -37.67 -50.6 1.19 Allowed 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -171.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.647 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.5 p-10 -100.62 7.44 43.98 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -173.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.5 mtt180 -128.5 139.59 52.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.227 0.537 . . . . 0.0 111.809 -173.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.08 128.16 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.05 171.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.402 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 9.8 tt -98.31 123.14 50.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 121.173 0.511 . . . . 0.0 110.641 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -112.59 108.13 17.1 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.848 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.451 ' SD ' HD11 ' A' ' 15' ' ' LEU . 70.5 mtm -108.34 130.67 55.19 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.093 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.424 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 65.8 mt -117.88 122.5 43.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.119 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.439 ' HG3' HH11 ' A' ' 110' ' ' ARG . 0.0 OUTLIER -68.49 -49.86 56.56 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.021 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -113.12 111.67 22.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.977 -1.011 . . . . 0.0 108.706 172.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -108.54 43.86 1.62 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.817 -171.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 m -61.55 -31.6 71.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 110.586 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -101.99 21.31 14.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.014 -176.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.92 -54.94 40.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.581 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -31.56 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.984 -174.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -66.02 -39.55 90.32 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.078 0.466 . . . . 0.0 109.755 177.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.557 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.2 mt -60.76 -52.77 57.68 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.195 173.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.22 -48.39 54.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.94 0.4 . . . . 0.0 110.388 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -59.83 -42.82 94.39 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.995 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.57 -50.16 68.37 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.057 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 13.4 mt -57.68 -43.31 84.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.135 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -74.7 -26.9 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 120.995 -0.282 . . . . 0.0 111.572 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -78.62 2.66 18.63 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.255 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.444 ' NE2' HG13 ' A' ' 80' ' ' ILE . 1.1 tm0? -74.13 161.27 30.17 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.776 0.322 . . . . 0.0 111.024 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.74 -66.24 0.58 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.696 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.424 ' N ' ' OE1' ' A' ' 125' ' ' GLN . 36.1 mtm180 -69.99 -3.02 14.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.282 176.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.507 ' SG ' ' N ' ' A' ' 129' ' ' ALA . 42.1 t 73.77 176.58 0.25 Allowed 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.212 0.605 . . . . 0.0 111.48 174.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.507 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -169.8 135.24 1.43 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.711 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.597 ' HB2' HG21 ' A' ' 67' ' ' THR . 39.2 mm-40 -102.23 113.64 27.1 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 173.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.411 HG13 HG21 ' A' ' 66' ' ' VAL . 46.1 t -94.16 120.13 43.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 -177.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.6 m -107.79 130.06 55.0 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.507 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.9 mp -106.37 114.54 28.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.659 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 27.0 mm-40 -76.13 150.18 37.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 -178.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 104.47 -100.82 1.86 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.001 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -133.84 146.66 50.82 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.725 0.298 . . . . 0.0 110.554 -178.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.733 ' HA ' ' HE3' ' A' ' 137' ' ' MET . 10.2 mmt -78.24 100.55 6.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.936 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.42 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 21.5 m-85 -55.42 -53.09 66.0 Favored Pre-proline 0 CA--C 1.541 0.626 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.462 -177.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.42 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 57.9 Cg_endo -70.01 107.27 1.87 Allowed 'Trans proline' 0 C--N 1.359 1.118 0 C-N-CA 121.859 1.706 . . . . 0.0 111.953 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 113.61 -22.42 15.0 Favored Glycine 0 N--CA 1.454 -0.149 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.989 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 66.5 mttm . . . . . 0 C--O 1.235 0.322 0 C-N-CA 122.357 0.263 . . . . 0.0 110.47 -179.599 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.748 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -79.02 76.76 5.51 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.03 0.443 . . . . 0.0 110.138 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.8 tt -81.24 64.63 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 122.122 0.963 . . . . 0.0 110.335 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.546 ' HA ' ' HB2' ' A' ' 7' ' ' ASN . 12.1 mtp180 -70.69 -17.54 62.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.732 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -54.55 -52.34 62.36 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.501 ' OH ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -66.27 -44.51 83.38 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.17 178.667 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.546 ' HB2' ' HA ' ' A' ' 4' ' ' ARG . 25.3 m-80 -51.3 -78.58 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.239 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.96 -59.88 3.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.788 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.58 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -67.86 -60.6 2.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -171.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.615 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 12.8 t70 -69.66 -39.13 77.25 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.974 -169.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.523 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 2.0 mmt -64.42 -45.5 87.31 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.65 -42.58 71.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.871 0.367 . . . . 0.0 110.218 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.615 ' HD2' ' HA ' ' A' ' 10' ' ' ASP . 81.9 mtt180 -54.09 -62.38 1.69 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.083 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.491 HD11 HD21 ' A' ' 15' ' ' LEU . 3.9 pp -80.33 -18.41 49.24 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -171.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.491 HD21 HD11 ' A' ' 14' ' ' LEU . 3.5 mm? -79.34 -30.49 42.73 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.132 -0.355 . . . . 0.0 110.945 175.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -50.09 -39.02 41.33 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.265 0.555 . . . . 0.0 110.513 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -61.28 -38.93 88.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.238 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.491 ' CZ2' ' HG2' ' A' ' 108' ' ' MET . 61.7 m95 -66.15 -42.48 88.98 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.211 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -62.59 -46.68 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.551 ' O ' HG13 ' A' ' 24' ' ' ILE . 22.9 tttm -51.58 -54.33 28.81 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.729 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.8 -38.88 76.79 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -173.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -60.0 -45.63 92.13 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.396 0.617 . . . . 0.0 109.377 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 36.9 m-20 -66.54 -28.56 68.64 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.4 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 20' ' ' LYS . 60.1 mt -70.83 -42.85 77.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.255 176.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -73.32 -16.97 61.35 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.047 0.451 . . . . 0.0 109.972 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.5 tp10 -58.89 -15.15 11.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.443 0.64 . . . . 0.0 109.639 168.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.45 28.14 11.99 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.238 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -160.51 158.88 30.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.443 ' N ' HD21 ' A' ' 29' ' ' LEU . 3.1 mm? . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.941 -175.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 62.9 mt . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 21.8 ptp -138.53 114.34 9.93 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.772 171.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 86.0 mtp -108.88 117.81 35.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.535 -173.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.504 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 1.3 m-85 -97.42 121.31 39.17 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.0 t -117.11 105.51 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.787 0.327 . . . . 0.0 110.492 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.565 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 10.1 m -78.29 105.84 9.8 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.761 HG13 HG22 ' A' ' 80' ' ' ILE . 41.3 t -88.97 -61.77 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.482 -170.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.505 ' HB2' ' HG3' ' A' ' 76' ' ' GLU . 47.4 t -92.59 -46.46 7.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.332 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.96 2.97 87.74 Favored Glycine 0 CA--C 1.519 0.287 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -168.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.543 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 9.3 t30 -121.81 132.0 24.32 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.423 ' O ' ' HB2' ' A' ' 102' ' ' SER . 46.5 Cg_endo -63.43 -15.46 48.58 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.59 2.86 . . . . 0.0 116.058 -165.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.543 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 0.9 OUTLIER -71.7 133.01 45.35 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.184 0.902 . . . . 0.0 112.437 -169.941 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -50.33 -42.14 52.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.386 -1.279 . . . . 0.0 113.589 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.81 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.0 mptp? -49.15 -60.84 2.45 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -165.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.505 ' HG3' ' HB2' ' A' ' 69' ' ' SER . 2.1 pm0 -50.81 -60.39 3.11 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.053 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.638 ' HA ' HG21 ' A' ' 80' ' ' ILE . 45.5 m -71.08 -28.36 64.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.841 -174.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.38 -52.24 66.45 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.453 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 43.6 mt-10 -64.97 -48.0 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.243 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.761 HG22 HG13 ' A' ' 68' ' ' VAL . 10.6 tp -62.31 -41.96 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.74 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 96.5 m -67.26 -32.95 74.32 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.862 0.363 . . . . 0.0 110.433 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.2 t -62.47 -40.31 96.22 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.625 HD12 HD11 ' A' ' 80' ' ' ILE . 77.0 mt -62.58 -44.75 95.53 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.497 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 49.0 m0 -57.25 -37.36 72.2 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.601 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.48 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 0.9 OUTLIER -62.3 -61.49 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.732 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.51 -19.84 43.03 Favored Glycine 0 CA--C 1.523 0.542 0 CA-C-N 115.683 -0.689 . . . . 0.0 114.266 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.499 ' HB2' HD13 ' A' ' 88' ' ' LEU . 18.1 m -96.38 -69.33 0.76 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.081 0.44 . . . . 0.0 111.193 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 87' ' ' SER . 4.7 mp -78.51 -57.46 3.76 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.952 0.406 . . . . 0.0 111.259 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.48 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 94.9 m-85 -68.85 -11.34 60.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.251 -173.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -71.98 -27.04 62.5 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.771 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.96 3.67 22.14 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.038 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 62.99 66.33 0.75 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.625 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -84.46 160.71 20.5 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.154 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -95.37 15.88 18.32 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.094 0.473 . . . . 0.0 110.93 -177.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.3 t -88.17 151.55 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.96 176.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -132.39 140.86 48.65 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.05 159.03 42.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.482 -0.192 . . . . 0.0 110.482 -173.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -138.53 154.84 48.78 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.695 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.3 tt -115.5 89.82 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.011 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -118.42 132.73 67.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 173.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 61.3 82.89 0.07 OUTLIER Glycine 0 C--N 1.332 0.34 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 -166.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 16.9 m -43.69 -42.15 5.17 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -166.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -52.46 -21.7 3.98 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.501 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 33.0 ttt180 -133.12 133.2 42.61 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 110.741 -175.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.88 134.39 52.13 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.2 tt -108.55 132.74 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.72 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -106.09 123.78 48.55 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.425 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.491 ' HG2' ' CZ2' ' A' ' 18' ' ' TRP . 2.1 mpt? -96.11 114.0 25.66 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 171.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 109' ' ' LEU . 2.2 mm? -101.34 103.81 14.78 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.471 -178.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.8 mmm-85 -76.24 -50.34 14.71 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 166.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -104.37 110.65 22.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.518 172.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -110.68 11.76 30.15 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.358 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.1 t -58.54 -40.19 82.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.103 0.478 . . . . 0.0 110.423 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -97.85 21.35 10.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.536 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.33 -37.65 88.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.057 0.456 . . . . 0.0 110.404 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -22.76 62.36 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.646 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -73.08 -37.42 66.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.439 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 mt -63.09 -47.82 90.74 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.26 173.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -57.46 -41.84 81.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -58.31 -44.93 88.83 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.343 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . 0.41 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 73.1 t80 -64.02 -50.35 68.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.249 177.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 96.4 mt -49.64 -43.91 47.16 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.941 177.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.647 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 28.7 m -84.83 -14.35 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-O 120.971 0.415 . . . . 0.0 111.033 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -80.27 1.1 29.91 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.121 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.497 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 40.9 mt-30 -71.84 165.09 24.83 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.965 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -54.21 -64.99 0.65 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.635 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -101.05 -15.46 17.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.052 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.647 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 48.8 t 70.88 170.11 0.32 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.068 0.547 . . . . 0.0 111.154 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.453 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -135.91 171.19 14.82 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.734 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.565 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 44.3 mt-10 -84.34 115.04 22.29 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.597 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -87.83 132.9 31.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.504 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 9.2 m -131.51 138.17 48.84 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.682 ' HB2' ' HG2' ' A' ' 137' ' ' MET . 35.1 mt -122.2 111.91 17.53 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -178.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.576 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 28.3 mm-40 -93.14 136.25 33.58 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.4 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.66 -60.08 0.44 Allowed Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 111.605 -0.598 . . . . 0.0 111.605 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -170.41 133.98 1.11 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.682 ' HG2' ' HB2' ' A' ' 133' ' ' LEU . 72.7 mtp -105.75 114.44 28.6 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.52 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 86.6 m-85 -61.29 -52.69 69.12 Favored Pre-proline 0 CA--C 1.541 0.626 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.1 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 19.8 Cg_endo -57.68 121.48 10.11 Favored 'Trans proline' 0 C--N 1.361 1.2 0 C-N-CA 122.217 1.945 . . . . 0.0 112.308 -175.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 99.03 -21.37 46.22 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.33 -0.462 . . . . 0.0 112.28 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 C--N 1.33 -0.278 0 CA-C-O 120.818 0.342 . . . . 0.0 110.575 -179.767 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.893 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -92.93 162.86 13.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.527 0.204 . . . . 0.0 111.106 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.684 HG12 ' HB3' ' A' ' 6' ' ' TYR . 9.5 tt 48.57 29.75 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.511 1.125 . . . . 0.0 112.408 174.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -56.01 -34.2 65.59 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.387 -177.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.53 -48.01 69.44 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.556 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.684 ' HB3' HG12 ' A' ' 3' ' ' ILE . 2.8 t80 -57.55 -47.11 82.94 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -52.78 -68.11 0.2 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.731 -177.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -54.63 -67.65 0.25 Allowed 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.343 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.55 -58.67 7.3 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.728 -171.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -66.4 -56.74 9.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.749 -172.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.667 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 10.5 mmt -59.63 -49.99 75.63 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.793 0.33 . . . . 0.0 110.663 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.13 -51.8 49.54 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.994 0.426 . . . . 0.0 111.291 -175.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.5 mtt180 -82.47 -6.99 59.64 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.993 -170.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -91.7 -52.54 4.71 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -72.65 -15.59 61.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.289 -176.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -48.4 -41.03 27.81 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.859 0.838 . . . . 0.0 109.51 170.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -68.19 -40.23 82.28 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.963 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 3.3 m95 -60.49 -41.44 94.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.86 0.362 . . . . 0.0 110.776 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.69 -47.01 88.17 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.554 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.6 tmtt? -52.3 -44.57 65.1 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.443 177.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -67.18 -45.96 75.4 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.641 0.257 . . . . 0.0 111.393 -178.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -58.32 -41.53 84.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.826 0.346 . . . . 0.0 110.678 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 22.0 m-20 -67.76 -36.1 79.9 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.782 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.8 mt -58.39 -43.42 86.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 175.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -37.59 87.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.428 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 37.5 tt0 -56.55 -22.39 32.99 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.91 174.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.73 31.78 14.7 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.27 -0.49 . . . . 0.0 112.34 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -141.22 129.3 22.05 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--O 1.235 0.335 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.53 -179.971 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 109' ' ' LEU . 2.2 tm? . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.509 0.671 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.638 ' SD ' ' HG3' ' A' ' 108' ' ' MET . 50.5 mtm -133.38 136.35 45.24 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 166.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 60.4 mtt -118.53 117.65 29.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.196 -174.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.63 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 16.6 m-85 -90.06 101.61 14.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 172.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.6 t -92.56 106.7 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.639 0.257 . . . . 0.0 111.264 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.572 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 87.7 m -83.06 108.28 16.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.65 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 42.7 t -100.97 -60.75 2.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.978 0.418 . . . . 0.0 111.523 -174.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.578 ' HB3' ' HB3' ' A' ' 76' ' ' GLU . 77.7 p -92.9 -60.33 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.3 19.99 79.79 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -164.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.46 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 8.8 t30 -127.34 133.18 24.79 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 115.19 -0.505 . . . . 0.0 109.822 -176.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 20.5 Cg_exo -65.0 -18.99 63.68 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.249 2.633 . . . . 0.0 114.704 -170.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 40.7 p -61.61 133.42 55.62 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.103 0.478 . . . . 0.0 111.769 -176.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.78 -29.17 70.51 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -177.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.497 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.97 -37.75 61.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.864 -176.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 69' ' ' SER . 5.3 mm-40 -55.04 -68.4 0.19 Allowed 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.821 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.5 t -64.4 -38.38 90.82 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.921 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.56 -61.66 2.34 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.765 0.317 . . . . 0.0 110.575 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -60.87 -50.01 75.15 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.247 -175.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.644 HD11 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -64.57 -43.7 96.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.088 -173.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.3 m -64.78 -34.27 77.95 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.635 0.255 . . . . 0.0 110.359 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -62.57 -40.2 96.11 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.644 HD12 HD11 ' A' ' 80' ' ' ILE . 82.3 mt -60.53 -45.75 92.67 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.132 0.491 . . . . 0.0 110.143 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.595 ' HZ3' ' HB1' ' A' ' 105' ' ' ALA . 44.3 m0 -60.79 -57.35 13.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.718 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.521 ' O ' ' HB2' ' A' ' 89' ' ' PHE . 26.0 tt0 -61.51 -23.6 66.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.075 0.464 . . . . 0.0 110.484 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.47 -31.89 58.38 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.026 175.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.2 m -94.23 -63.42 1.19 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.499 HD23 HG13 ' A' ' 118' ' ' ILE . 6.1 mp -62.23 -46.99 86.37 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -173.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.521 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 33.8 m-85 -71.36 -11.32 60.84 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.467 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -70.46 -46.3 64.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 173.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.79 -10.17 59.21 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.977 173.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.7 t30 72.59 48.42 0.22 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.14 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -74.36 100.83 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -73.39 84.38 1.46 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.43 0.633 . . . . 0.0 110.933 -175.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.776 HG11 HD23 ' A' ' 109' ' ' LEU . 4.5 m -111.29 162.01 9.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.115 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.437 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.1 tp60 -101.32 103.79 14.78 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 173.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.499 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -102.04 130.16 48.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.439 -175.834 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -119.63 136.44 54.39 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.6 tt -118.65 107.07 20.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.281 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.48 139.87 10.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.07 103.23 0.13 Allowed Glycine 0 C--O 1.224 -0.488 0 C-N-CA 120.342 -0.933 . . . . 0.0 111.584 -176.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 p -46.85 -35.27 6.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.528 ' HB2' HG21 ' A' ' 3' ' ' ILE . 12.7 t70 -53.23 -38.96 63.41 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.572 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 51.7 mtt180 -138.31 167.43 21.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 122.182 0.991 . . . . 0.0 112.821 -167.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.595 ' HB1' ' HZ3' ' A' ' 84' ' ' TRP . . . -143.88 153.84 42.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.543 162.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.45 HG12 ' SD ' ' A' ' 108' ' ' MET . 12.4 tt -127.0 145.56 34.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -170.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -122.34 120.11 33.06 Favored 'General case' 0 CA--C 1.523 -0.063 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.978 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.638 ' HG3' ' SD ' ' A' ' 63' ' ' MET . 4.3 mpp? -103.45 124.09 48.08 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 173.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.776 HD23 HG11 ' A' ' 95' ' ' VAL . 9.1 mt -128.46 141.21 51.47 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.406 0.622 . . . . 0.0 111.479 -177.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.1 mtp-105 -105.91 6.28 31.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.255 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -139.31 138.75 36.97 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -121.57 24.96 7.06 Favored Glycine 0 N--CA 1.453 -0.2 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.474 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.0 m -60.3 -37.75 81.51 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.243 0.544 . . . . 0.0 110.482 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -117.13 24.96 10.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.853 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.07 -47.51 82.63 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.201 0.524 . . . . 0.0 111.061 -178.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -76.72 -20.1 56.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.175 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.14 -48.88 31.76 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.245 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.499 HG13 HD23 ' A' ' 88' ' ' LEU . 8.4 tt -63.5 -41.19 91.81 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.07 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -58.83 -45.27 90.42 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.268 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.3 -40.73 87.11 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.29 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -65.11 -44.2 89.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.1 mt -60.74 -38.63 85.79 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.369 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 31.2 m -87.38 -12.0 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-O 120.853 0.358 . . . . 0.0 111.174 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 17.7 t -86.77 2.05 50.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.383 175.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.494 HE22 ' HZ2' ' A' ' 84' ' ' TRP . 58.5 mt-30 -60.75 164.31 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.149 -176.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -54.44 -61.64 2.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.32 178.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -80.95 -11.28 59.6 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.55 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 60.0 m 65.77 114.62 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.087 0.555 . . . . 0.0 110.979 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -102.61 144.9 30.42 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.914 -177.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -91.61 127.25 36.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.974 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 43.6 t -106.53 109.86 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.254 -174.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.488 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 31.4 p -92.7 127.12 38.09 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.436 HD13 ' HG2' ' A' ' 137' ' ' MET . 83.0 mt -87.19 163.17 17.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.926 0.393 . . . . 0.0 111.593 -172.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.516 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 62.2 tt0 -59.83 116.49 4.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.333 -0.848 . . . . 0.0 111.412 176.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 72.01 -73.53 0.85 Allowed Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.94 -0.573 . . . . 0.0 113.368 173.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -161.08 154.93 22.34 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -177.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.436 ' HG2' HD13 ' A' ' 133' ' ' LEU . 85.8 mtp -62.34 110.73 1.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.842 0.354 . . . . 0.0 110.443 176.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.61 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 35.1 p90 -72.07 -31.48 1.73 Allowed Pre-proline 0 CA--C 1.547 0.83 0 CA-C-O 118.8 -0.619 . . . . 0.0 112.659 177.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.61 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 37.0 Cg_endo -65.27 123.96 12.27 Favored 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 121.197 1.264 . . . . 0.0 111.155 173.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 105.87 153.02 20.69 Favored Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 C--O 1.237 0.412 0 CA-C-O 120.678 0.275 . . . . 0.0 110.424 -179.379 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 112.101 -0.4 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -113.08 108.56 17.49 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt -78.36 -2.81 5.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.105 -176.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -56.64 -38.78 72.6 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.841 -178.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.77 -49.27 77.15 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 177.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -55.72 -43.31 76.41 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.954 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.448 ' OD1' ' HD2' ' A' ' 104' ' ' ARG . 0.9 OUTLIER -58.46 -53.34 59.39 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.151 -177.254 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -52.68 -61.56 2.21 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.84 -61.45 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.509 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.78 -60.0 4.36 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.075 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.434 ' O ' HD23 ' A' ' 15' ' ' LEU . 26.2 mmt -59.4 -52.1 67.08 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.226 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.72 89.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.794 0.33 . . . . 0.0 111.084 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -72.15 -23.94 61.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.748 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.1 tp -80.71 -52.69 7.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.94 0.4 . . . . 0.0 110.625 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.434 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -68.08 -20.61 64.96 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.432 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -48.78 -38.28 21.48 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.504 0.668 . . . . 0.0 109.873 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -69.16 -43.68 73.78 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.002 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -59.04 -41.86 88.84 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 120.897 0.38 . . . . 0.0 110.715 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -61.71 -46.28 90.33 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.5 tmtt? -55.77 -40.88 73.24 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.439 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.434 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 7.4 m-20 -71.03 -44.67 65.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.33 -31.6 72.8 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 121.169 0.509 . . . . 0.0 109.808 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 6.2 m-20 -66.62 -44.98 80.6 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.766 174.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.3 mt -61.26 -34.18 59.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -69.09 -31.33 69.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.004 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.43 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.0 tp10 -64.99 -17.85 64.79 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.262 0.553 . . . . 0.0 110.071 170.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.68 29.42 13.6 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.239 -178.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -136.93 126.14 24.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 177.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.437 ' N ' HD21 ' A' ' 29' ' ' LEU . 2.9 mm? . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.614 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.257 0 CA-C-O 121.161 0.505 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 13.5 ptm -145.21 116.06 7.77 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.551 175.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.54 ' HE1' ' HG ' ' A' ' 133' ' ' LEU . 67.0 mtt -120.23 144.77 47.57 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.55 -174.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.522 ' HB3' ' HD3' ' A' ' 104' ' ' ARG . 41.6 m-85 -123.75 100.31 6.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.954 177.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.537 HG21 HD12 ' A' ' 122' ' ' LEU . 16.3 t -91.96 109.73 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -171.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 57.9 m -79.91 104.69 10.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.07 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.433 HG13 HG12 ' A' ' 80' ' ' ILE . 25.5 t -101.86 -58.82 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.049 0.452 . . . . 0.0 111.193 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.722 ' HB2' ' HA ' ' A' ' 103' ' ' ASP . 5.1 m -65.44 -69.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.217 -170.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.21 3.66 89.72 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.45 -0.66 . . . . 0.0 111.45 -171.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.434 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 10.0 t30 -123.13 136.16 26.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 33.6 Cg_exo -60.35 -19.34 57.78 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.284 2.656 . . . . 0.0 114.301 -173.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 m -81.63 140.96 34.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.24 -0.287 . . . . 0.0 110.446 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -72.75 -19.67 61.33 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -171.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -32.16 -61.02 0.26 Allowed 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.616 0.722 . . . . 0.0 112.29 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.41 -51.98 63.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.617 -169.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.576 HG23 HD13 ' A' ' 99' ' ' ILE . 9.6 t -66.04 -33.97 77.01 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.83 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.21 -52.63 57.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.897 0.38 . . . . 0.0 110.126 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.1 -49.4 76.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.104 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.514 HD13 ' HG2' ' A' ' 125' ' ' GLN . 10.1 tp -67.52 -42.96 87.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -175.11 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.4 m -68.7 -25.13 64.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.685 0.279 . . . . 0.0 110.405 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.8 t -67.31 -48.52 67.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 173.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.463 HD13 HD12 ' A' ' 80' ' ' ILE . 86.1 mt -55.24 -43.7 74.81 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.335 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.602 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.8 m0 -67.01 -43.83 81.9 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.118 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -55.16 -28.83 55.71 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.365 0.602 . . . . 0.0 109.592 175.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -76.26 -68.2 1.57 Allowed Glycine 0 CA--C 1.518 0.233 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.225 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.7 m -57.54 -54.4 47.24 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.3 mp -64.1 -29.0 70.16 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 111.281 -172.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -101.29 6.24 42.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.475 0.655 . . . . 0.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -89.68 -32.33 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 167.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.56 -14.39 37.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.637 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.0 m120 66.51 80.33 0.22 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.269 176.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -111.58 120.71 43.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.793 171.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.42 83.03 1.95 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.239 0.542 . . . . 0.0 110.254 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.603 HG21 ' HD2' ' A' ' 97' ' ' ARG . 12.5 m -111.07 148.78 14.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.852 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.5 tp60 -100.79 100.56 11.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.68 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -125.67 141.23 52.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.204 -169.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.461 ' O ' HG23 ' A' ' 106' ' ' ILE . 81.5 m-85 -138.72 135.63 34.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.304 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.576 HD13 HG23 ' A' ' 77' ' ' THR . 5.0 tt -87.0 89.76 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.536 0.684 . . . . 0.0 109.445 173.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -135.28 130.71 51.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.307 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 93.83 103.43 1.7 Allowed Glycine 0 C--O 1.225 -0.465 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -171.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -40.9 -34.9 0.45 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.722 ' HA ' ' HB2' ' A' ' 69' ' ' SER . 7.8 p-10 -89.56 -48.4 7.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.521 0.2 . . . . 0.0 111.472 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.522 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 61.6 mtt180 -88.51 155.0 19.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -173.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -128.35 140.72 51.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.379 165.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.461 HG23 ' O ' ' A' ' 98' ' ' PHE . 8.0 tt -109.69 132.09 58.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 111.433 -172.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -123.22 107.69 11.98 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.261 176.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.406 ' SD ' HD11 ' A' ' 15' ' ' LEU . 66.5 mtm -102.1 118.81 37.68 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.52 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.614 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 28.6 mt -110.89 131.39 55.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.436 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 29.8 mmm-85 -88.99 4.26 48.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.347 0.594 . . . . 0.0 109.601 173.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -146.13 135.08 22.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.336 176.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -114.11 23.54 12.65 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.99 -176.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.2 t -64.67 -44.87 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -101.61 26.52 7.25 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.005 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -50.38 72.88 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.131 0.491 . . . . 0.0 111.753 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -28.54 62.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 -177.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -69.02 -48.41 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.42 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.573 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.2 tt -63.93 -41.41 92.41 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.474 ' HG2' HG11 ' A' ' 131' ' ' VAL . 14.1 tmtt? -57.56 -49.88 74.92 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 121.05 0.452 . . . . 0.0 110.229 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -56.65 -40.79 76.08 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.553 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -66.14 -47.71 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.918 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 88.8 mt -53.46 -44.77 69.18 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.403 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 28.7 m -81.77 -14.68 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.734 0.302 . . . . 0.0 111.481 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -74.26 1.55 11.17 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.769 0.427 . . . . 0.0 111.633 175.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.602 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.4 mp0 -76.85 164.53 25.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.401 0.619 . . . . 0.0 112.408 -174.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -79.76 -45.67 18.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.567 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -66.84 -3.17 6.22 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.726 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 43.6 t 62.51 91.32 0.07 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.222 0.534 . . . . 0.0 110.403 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.16 132.69 45.38 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.537 -177.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -108.27 124.53 50.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.841 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.504 ' HA ' ' HA ' ' A' ' 66' ' ' VAL . 6.5 p -102.84 127.97 56.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.103 0.478 . . . . 0.0 111.735 -173.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.6 m -87.06 121.33 29.37 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.54 ' HG ' ' HE1' ' A' ' 64' ' ' MET . 2.2 tt -105.2 113.45 27.05 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -172.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -120.11 151.36 39.17 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.068 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 112.92 43.32 0.87 Allowed Glycine 0 N--CA 1.454 -0.137 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.099 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 70.35 144.47 0.06 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.331 0.586 . . . . 0.0 111.155 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.586 ' HA ' ' HE3' ' A' ' 137' ' ' MET . 29.3 mmt -90.15 110.02 21.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.275 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.617 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 75.3 m-85 -58.55 -51.47 81.62 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.821 178.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.617 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 47.4 Cg_endo -91.5 179.21 1.57 Allowed 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 122.467 2.111 . . . . 0.0 112.309 177.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 86.37 -77.27 2.04 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.306 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 85.2 tttt . . . . . 0 C--O 1.236 0.371 0 CA-C-O 120.631 0.253 . . . . 0.0 110.558 -178.139 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 111.748 -0.541 . . . . 0.0 111.748 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -94.61 -54.99 3.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.211 0.529 . . . . 0.0 109.779 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mm -94.16 -31.65 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.007 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -56.41 -50.54 71.33 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.588 0.233 . . . . 0.0 111.609 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.86 -48.97 74.59 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -47.84 73.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.176 176.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.581 ' O ' ' HB2' ' A' ' 11' ' ' MET . 93.4 m-20 -53.12 -76.41 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.947 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.64 -64.07 0.94 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.832 -176.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.555 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -65.59 -61.24 2.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.846 -171.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -74.95 -30.49 61.23 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -168.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.639 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 10.0 mmt -71.42 -37.43 71.48 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.222 175.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.92 -48.08 83.15 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.16 173.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 85.7 mtt180 -59.05 -45.31 91.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.188 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.497 HD22 ' HD2' ' A' ' 98' ' ' PHE . 61.3 tp -71.1 -53.2 15.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.853 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 11' ' ' MET . 4.1 mm? -69.12 -18.59 63.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.129 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -48.74 -49.95 35.91 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.021 0.439 . . . . 0.0 110.799 175.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.445 ' HG3' ' N ' ' A' ' 18' ' ' TRP . 7.1 pt20 -66.71 -35.22 79.61 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.548 -177.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.464 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 76.8 m95 -67.03 -42.24 85.2 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.088 0.471 . . . . 0.0 110.428 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.07 -48.89 79.94 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.581 ' O ' HG13 ' A' ' 24' ' ' ILE . 88.2 tttt -57.59 -45.75 84.9 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.668 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -58.13 -54.16 50.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.984 0.421 . . . . 0.0 110.846 -177.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.54 -39.36 79.98 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.669 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 4.0 m-20 -72.56 -30.73 64.68 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.514 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 20' ' ' LYS . 67.9 mt -65.11 -37.75 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.91 -26.7 60.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.547 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 4.9 mm-40 -62.14 -17.32 57.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.233 166.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.46 9.76 62.75 Favored Glycine 0 N--CA 1.453 -0.203 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.824 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.91 124.96 47.3 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.429 ' N ' HD21 ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 C--N 1.327 -0.379 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.538 ' HB3' ' HG ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.425 0 CA-C-O 121.901 0.858 . . . . 0.0 113.254 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.605 ' HE3' ' HG3' ' A' ' 134' ' ' GLU . 72.9 mtm -142.32 133.66 26.36 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.307 168.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.586 ' HE3' ' HB2' ' A' ' 119' ' ' LYS . 63.0 mtt -114.64 129.15 56.64 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -172.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.524 ' HE1' ' HA ' ' A' ' 134' ' ' GLU . 43.5 m-85 -91.1 116.46 28.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 168.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -112.96 108.2 24.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.665 0.269 . . . . 0.0 110.965 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.761 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 37.8 m -77.15 106.52 8.92 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.418 HG23 HG23 ' A' ' 77' ' ' THR . 97.9 t -85.24 -61.05 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.081 0.467 . . . . 0.0 111.682 -172.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.5 t -91.65 -41.61 10.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.931 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.56 -10.18 65.41 Favored Glycine 0 C--N 1.33 0.243 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -167.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.531 HD22 HG21 ' A' ' 73' ' ' THR . 8.2 t30 -126.23 130.82 23.85 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 123.865 0.866 . . . . 0.0 109.004 178.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.3 -16.61 0.25 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.185 3.257 . . . . 0.0 116.263 -171.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.531 HG21 HD22 ' A' ' 71' ' ' ASN . 19.9 p -60.18 97.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.682 0.674 . . . . 0.0 112.347 -172.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.41 ' CA ' ' HB3' ' A' ' 102' ' ' SER . 40.0 tt0 -43.34 -30.92 0.57 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.132 -0.94 . . . . 0.0 112.415 176.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -35.04 -66.9 0.16 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 123.998 0.811 . . . . 0.0 111.935 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -62.93 -43.75 97.94 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.975 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.418 HG23 HG23 ' A' ' 68' ' ' VAL . 38.6 m -63.93 -39.8 94.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.282 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.54 -50.01 60.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.384 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.84 -54.16 45.97 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 120.985 0.422 . . . . 0.0 110.929 177.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.626 HD11 HD13 ' A' ' 83' ' ' LEU . 10.2 tp -67.07 -40.0 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.324 -174.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.466 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 70.5 m -61.48 -37.34 83.26 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.673 0.273 . . . . 0.0 110.394 176.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.9 m -61.02 -44.84 96.82 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.626 HD13 HD11 ' A' ' 80' ' ' ILE . 78.3 mt -58.53 -47.48 84.04 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 176.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.684 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 48.9 m0 -58.7 -45.87 88.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.093 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.6 mt-30 -58.51 -60.03 4.44 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.44 -40.06 10.73 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.342 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 m -73.17 -58.02 3.61 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 111.373 -178.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.3 mt -57.99 -54.14 50.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -174.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -65.94 -31.13 71.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.38 -174.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.66 -24.07 59.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.282 0.563 . . . . 0.0 109.723 176.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.13 14.4 12.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.43 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.5 t30 73.26 9.46 5.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.703 175.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -81.28 91.92 6.29 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.038 -0.413 . . . . 0.0 109.968 176.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.77 94.46 7.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.08 165.25 16.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.316 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.484 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.1 tp60 -104.53 152.97 21.74 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 177.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.526 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -155.65 126.82 7.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.78 0.324 . . . . 0.0 110.36 -177.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.497 ' HD2' HD22 ' A' ' 14' ' ' LEU . 15.8 m-30 -113.82 124.15 51.53 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 tt -102.32 88.77 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 122.136 0.97 . . . . 0.0 109.734 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.39 141.98 45.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.111 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 67.19 76.27 0.39 Allowed Glycine 0 C--O 1.224 -0.489 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -169.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.41 ' HB3' ' CA ' ' A' ' 74' ' ' GLU . 24.6 m -35.21 -34.6 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -165.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.76 -34.17 72.63 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.176 0.513 . . . . 0.0 111.849 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.483 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 88.3 mtt180 -128.09 134.69 49.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.162 0.506 . . . . 0.0 111.93 -171.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.64 128.56 54.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.539 -0.755 . . . . 0.0 108.975 173.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.6 tt -104.46 133.14 49.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 110.704 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -116.11 129.62 56.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.07 -177.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.572 ' HA ' ' HG2' ' A' ' 63' ' ' MET . 2.0 mpt? -108.87 122.71 47.77 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.679 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.538 ' HG ' ' HB3' ' A' ' 62' ' ' LEU . 0.8 OUTLIER -128.01 114.75 17.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 172.1 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -61.79 -34.32 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -170.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -118.38 111.49 18.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.101 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.54 48.46 3.9 Favored Glycine 0 C--N 1.332 0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.166 -174.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.4 t -68.39 -71.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.981 0.419 . . . . 0.0 110.003 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.1 p90 -80.54 30.17 0.3 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.631 177.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.82 -41.53 82.42 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.234 0.54 . . . . 0.0 111.445 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 21.0 m95 -75.11 -32.89 61.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.009 -174.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.83 -53.57 44.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.153 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.2 tt -61.62 -38.36 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.079 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.586 ' HB2' ' HE3' ' A' ' 64' ' ' MET . 24.5 ttpp -53.51 -55.55 24.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.144 0.497 . . . . 0.0 110.788 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.661 ' HA ' HG21 ' A' ' 123' ' ' VAL . 3.3 m-20 -64.22 -30.99 72.02 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.846 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -64.93 -36.51 84.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.959 0.409 . . . . 0.0 110.034 176.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 81.3 mt -67.43 -46.26 73.67 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.278 178.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.661 HG21 ' HA ' ' A' ' 120' ' ' ASP . 12.5 m -82.21 -4.51 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.582 -177.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.4 t -70.04 1.24 4.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.92 0.488 . . . . 0.0 111.765 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.684 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -83.19 143.11 30.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.007 0.432 . . . . 0.0 111.529 -174.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -43.89 -62.35 1.15 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.063 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 48.9 ttt180 -80.78 21.24 0.69 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 56.6 m 70.99 -166.94 0.15 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.701 0.4 . . . . 0.0 111.779 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 171.71 119.41 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.603 -176.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.761 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 34.8 mt-10 -87.17 144.14 26.98 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.2 p -138.72 139.72 40.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.926 0.393 . . . . 0.0 111.302 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 18.2 p -138.33 140.47 39.51 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 176.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 137' ' ' MET . 61.3 mt -88.4 154.31 20.48 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.639 0.257 . . . . 0.0 111.172 -176.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.605 ' HG3' ' HE3' ' A' ' 63' ' ' MET . 1.7 tm-20 -69.0 138.71 54.75 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 70.3 17.11 73.91 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.629 -172.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 74.61 167.25 0.29 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.745 0.818 . . . . 0.0 110.999 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.42 ' HA ' HD12 ' A' ' 133' ' ' LEU . 27.1 ttt -60.57 107.03 0.62 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.622 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.492 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 37.0 m-85 -55.44 -52.39 72.07 Favored Pre-proline 0 CA--C 1.542 0.635 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.052 -176.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.492 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 72.5 Cg_endo -76.01 127.08 9.75 Favored 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 121.842 1.695 . . . . 0.0 111.994 179.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 110.77 -121.63 5.93 Favored Glycine 0 C--N 1.331 0.301 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt . . . . . 0 C--O 1.235 0.303 0 CA-C-O 120.658 0.266 . . . . 0.0 110.439 -178.887 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -80.38 55.62 2.31 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.199 0.524 . . . . 0.0 110.938 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.766 HG12 ' HB3' ' A' ' 6' ' ' TYR . 15.0 tt -82.59 40.61 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 CA-C-O 122.316 1.055 . . . . 0.0 109.039 176.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -55.41 -43.41 75.25 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 114.495 -1.23 . . . . 0.0 112.274 -169.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.98 -46.13 71.59 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.082 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.766 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -58.57 -47.15 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.989 176.656 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.568 ' O ' ' HB2' ' A' ' 11' ' ' MET . 90.6 m-20 -55.15 -71.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.405 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -51.23 -69.47 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.093 -178.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.17 -58.75 7.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.746 -171.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.96 -45.97 55.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.915 -168.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.61 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 17.2 mmt -69.01 -43.27 75.14 Favored 'General case' 0 N--CA 1.461 0.125 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.707 -176.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.47 -49.94 67.19 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.835 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -67.95 -27.81 66.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.653 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -78.78 -52.09 8.86 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.891 0.377 . . . . 0.0 111.2 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.435 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -72.55 -25.13 61.25 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -173.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -59.75 -29.45 68.17 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -55.8 -58.11 9.21 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.854 174.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.1 m95 -58.94 -30.15 67.67 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.667 -178.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.82 -62.89 1.53 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.379 175.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.473 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.1 ttmt -57.37 -47.14 82.42 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.152 -178.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.42 -46.49 73.21 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 123.377 0.423 . . . . 0.0 110.632 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 28.6 t70 -61.64 -41.9 98.14 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.141 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -66.89 -24.87 66.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.08 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 20' ' ' LYS . 70.5 mt -71.28 -37.5 66.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 174.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -68.34 -31.55 71.02 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.571 173.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 22' ' ' ASP . 14.9 mm-40 -69.21 -35.38 76.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.349 0.595 . . . . 0.0 109.645 172.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.64 48.02 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.726 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -116.88 94.2 4.5 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.417 ' N ' HD23 ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.533 0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.027 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.466 HD21 ' HE3' ' A' ' 64' ' ' MET . 1.9 tm? . . . . . 0 C--O 1.235 0.296 0 CA-C-O 121.062 0.458 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.675 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 17.1 ptm -140.87 111.74 7.07 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.867 176.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.466 ' HE3' HD21 ' A' ' 62' ' ' LEU . 61.5 mtt -113.47 130.21 56.38 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.385 -174.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -100.05 118.86 37.31 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.421 HG21 HG12 ' A' ' 131' ' ' VAL . 35.4 t -113.94 101.7 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 -175.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.62 HG22 ' HB2' ' A' ' 130' ' ' GLU . 5.1 t -83.19 106.2 14.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 109.459 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.405 HG13 HG12 ' A' ' 80' ' ' ILE . 17.3 t -101.29 -60.78 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.831 -173.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.3 t -72.57 -59.7 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.685 -176.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 75.62 0.92 64.57 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.523 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.442 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 9.1 t30 -126.26 132.29 24.26 Favored Pre-proline 0 CA--C 1.535 0.367 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 32.6 Cg_exo -58.71 -17.91 38.2 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.628 2.886 . . . . 0.0 114.513 -171.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.457 ' HG1' ' HG2' ' A' ' 76' ' ' GLU . 36.1 p -57.9 107.16 0.43 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 111.912 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -47.61 -31.27 4.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.04 0.936 . . . . 0.0 112.641 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.533 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 11.9 mptt -49.29 -50.88 37.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.135 0.493 . . . . 0.0 111.081 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.457 ' HG2' ' HG1' ' A' ' 73' ' ' THR . 17.6 mm-40 -59.3 -50.33 74.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.452 -174.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.436 HG21 HD12 ' A' ' 99' ' ' ILE . 14.6 t -67.83 -39.47 83.88 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.793 -175.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.06 -53.3 59.91 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -54.95 -63.13 1.25 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.135 179.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.405 HG12 HG13 ' A' ' 68' ' ' VAL . 11.4 tp -63.41 -46.35 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.599 -171.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 55.3 m -67.99 -31.72 71.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.488 -0.132 . . . . 0.0 111.159 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.1 t -67.73 -44.45 77.57 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 177.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 99.3 mt -60.69 -40.94 94.05 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.508 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 40.1 m0 -62.98 -47.79 81.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.664 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -55.73 -57.84 10.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.027 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -43.93 -58.34 4.33 Favored Glycine 0 C--N 1.333 0.395 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.991 173.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -49.53 75.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 95.3 mt -60.71 -56.57 19.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.083 -177.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -68.34 -20.3 64.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.07 -177.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -68.73 -38.0 79.85 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.164 0.507 . . . . 0.0 110.197 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.8 5.72 50.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.224 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 64.64 65.12 0.64 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.596 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 17.4 m-85 -102.1 88.16 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 168.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -77.21 72.57 3.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 109.785 -177.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.814 HG11 HD23 ' A' ' 109' ' ' LEU . 4.5 m -104.62 161.02 4.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.015 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.437 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.4 tp60 -102.0 105.42 16.18 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.636 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -119.96 145.35 46.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.972 -174.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.467 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 81.8 m-85 -130.97 127.01 37.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.068 0.461 . . . . 0.0 109.951 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.436 HD12 HG21 ' A' ' 77' ' ' THR . 7.5 tt -99.26 90.51 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.935 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -136.86 128.71 43.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.584 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.26 97.99 0.15 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 -172.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.9 m -45.19 -32.58 1.93 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -172.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.434 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 2.5 m-20 -57.47 -51.92 67.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.471 177.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.418 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 69.9 mtt180 -120.92 134.37 55.3 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -171.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.91 127.96 55.06 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 168.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.467 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 6.1 tt -98.71 132.94 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.989 0.423 . . . . 0.0 111.257 -177.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -124.22 123.8 41.05 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.593 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 76.6 mtm -128.12 146.81 50.59 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.267 0.556 . . . . 0.0 111.41 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.814 HD23 HG11 ' A' ' 95' ' ' VAL . 22.4 mt -133.28 137.64 46.1 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.436 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.37 -55.42 4.17 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 172.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -128.3 111.51 13.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.466 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.91 95.91 0.12 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.308 -176.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.5 t -70.66 -23.39 62.5 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 109.872 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.29 14.36 1.23 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.914 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.74 75.38 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.051 0.453 . . . . 0.0 111.529 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 16.8 m95 -79.49 -23.86 42.7 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.185 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -72.67 -48.45 39.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.881 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.1 tt -64.17 -41.29 91.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.6 -41.45 81.26 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.401 ' HA ' HG21 ' A' ' 123' ' ' VAL . 27.4 t70 -60.8 -40.8 94.04 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.153 177.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -60.66 -40.44 92.04 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.435 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 47.7 mt -65.96 -40.55 91.39 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.256 -178.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.401 HG21 ' HA ' ' A' ' 120' ' ' ASP . 24.6 m -81.07 -22.91 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 120.809 0.338 . . . . 0.0 111.245 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.5 m -87.17 2.7 49.11 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.127 0.489 . . . . 0.0 110.583 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.508 ' NE2' ' NE1' ' A' ' 84' ' ' TRP . 6.6 tp-100 -66.74 156.47 35.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.621 -174.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -45.16 -67.74 0.26 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.001 0.52 . . . . 0.0 111.879 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -69.77 -17.84 63.45 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.604 177.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 42.3 t 68.8 116.59 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.609 0.568 . . . . 0.0 109.919 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.59 143.28 32.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.934 -175.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.62 ' HB2' HG22 ' A' ' 67' ' ' THR . 38.9 mt-10 -91.66 113.39 25.64 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.01 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.421 HG12 HG21 ' A' ' 66' ' ' VAL . 37.5 t -104.25 138.73 27.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -178.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.5 p -125.54 136.34 53.22 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.542 HD13 ' HG2' ' A' ' 137' ' ' MET . 62.4 mt -94.13 110.89 22.58 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.675 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 53.8 mm-40 -67.03 129.82 41.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 -177.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 96.5 6.02 58.73 Favored Glycine 0 CA--C 1.518 0.222 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 -171.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 74.44 160.45 0.23 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.908 0.883 . . . . 0.0 111.709 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.542 ' HG2' HD13 ' A' ' 133' ' ' LEU . 76.9 mtp -69.58 101.32 1.6 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.299 -177.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.653 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 35.7 p90 -73.69 -28.36 0.91 Allowed Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.312 173.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 37.9 Cg_endo -66.2 118.34 5.43 Favored 'Trans proline' 0 C--N 1.369 1.617 0 C-N-CA 121.455 1.437 . . . . 0.0 111.309 171.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 81.33 -126.2 7.27 Favored Glycine 0 C--N 1.332 0.31 0 N-CA-C 111.454 -0.658 . . . . 0.0 111.454 -177.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 N--CA 1.466 0.372 0 CA-C-N 116.944 0.372 . . . . 0.0 110.363 177.676 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.78 0 N-CA-C 111.753 -0.539 . . . . 0.0 111.753 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -120.58 166.41 13.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.977 0.417 . . . . 0.0 110.83 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt -107.55 11.92 8.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 121.969 0.89 . . . . 0.0 108.796 174.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.5 ttm105 -51.95 -31.79 30.41 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.524 -176.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -54.73 -45.6 74.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.627 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.0 -44.04 98.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 178.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.568 ' O ' ' HB2' ' A' ' 11' ' ' MET . 1.1 m-80 -53.77 -70.39 0.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.45 -62.68 1.5 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.935 -175.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.49 -64.27 1.0 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.758 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -68.0 -39.44 83.23 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.672 -169.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.568 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 24.2 mmt -70.52 -45.99 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.979 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -59.65 -43.64 93.81 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.052 0.454 . . . . 0.0 110.484 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -72.54 -31.68 65.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.469 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.9 tp -71.59 -52.77 16.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.962 0.411 . . . . 0.0 110.29 177.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.76 -17.02 61.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.174 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 16.5 tp10 -51.07 -49.75 60.04 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 121.268 0.556 . . . . 0.0 110.206 173.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 21' ' ' ASP . 18.2 tt0 -64.93 -43.01 94.14 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 m95 -55.09 -41.88 72.16 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.612 0.57 . . . . 0.0 110.833 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.28 -52.32 66.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.621 ' HE2' HD11 ' A' ' 24' ' ' ILE . 88.2 tttt -62.22 -27.68 69.15 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.946 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 17' ' ' GLN . 35.6 m-20 -67.83 -49.39 62.47 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -72.27 -25.84 61.76 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.052 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -61.97 -54.6 39.45 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.285 0.564 . . . . 0.0 110.391 171.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.621 HD11 ' HE2' ' A' ' 20' ' ' LYS . 77.8 mt -59.17 -35.87 59.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.995 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.97 -42.64 99.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.195 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -78.2 3.29 15.62 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.034 0.445 . . . . 0.0 110.93 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.22 53.12 3.21 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 116.236 -0.438 . . . . 0.0 113.95 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -158.64 136.2 10.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.034 0.417 . . . . 0.0 111.171 175.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.567 HD12 HG12 ' A' ' 24' ' ' ILE . 2.5 mm? . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.403 HD13 ' HB3' ' A' ' 115' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 121.719 0.771 . . . . 0.0 112.738 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.44 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 18.0 ptp -136.47 127.27 27.37 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.739 -1.118 . . . . 0.0 108.786 172.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.7 mtt -110.35 125.32 53.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 0.0 111.344 -173.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.505 ' HE2' ' SD ' ' A' ' 11' ' ' MET . 49.8 m-85 -102.91 105.01 15.29 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.62 HG23 HD12 ' A' ' 122' ' ' LEU . 21.7 t -98.11 105.41 17.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.245 -171.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.8 m -79.02 103.5 9.01 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.607 HG11 HG12 ' A' ' 80' ' ' ILE . 26.0 t -96.18 -62.71 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.811 0.338 . . . . 0.0 111.739 -171.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.6 t -92.56 -64.3 1.12 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.426 -173.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.488 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 89.78 -9.25 77.86 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 -172.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -92.72 125.49 55.33 Favored Pre-proline 0 CA--C 1.532 0.273 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.38 -19.8 68.38 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.172 2.581 . . . . 0.0 114.21 -170.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.421 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.5 m -66.04 113.93 4.83 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 52.3 mt-10 -60.45 -24.65 65.39 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -168.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -49.96 -31.23 12.07 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.894 0.378 . . . . 0.0 111.593 -178.911 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.532 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 31.6 mm-40 -60.37 -60.09 4.37 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.083 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.619 ' HB ' ' HA ' ' A' ' 102' ' ' SER . 15.1 t -62.82 -33.43 75.21 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.511 -178.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -54.94 -59.29 4.94 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.08 176.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -57.47 -54.54 45.71 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.149 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.652 HD13 ' HG2' ' A' ' 125' ' ' GLN . 9.6 tp -63.91 -44.95 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.779 -171.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.413 HG22 ' HB ' ' A' ' 99' ' ' ILE . 39.5 m -67.03 -34.29 77.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.543 0.211 . . . . 0.0 110.61 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.2 t -63.62 -45.09 91.83 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.896 0.379 . . . . 0.0 110.201 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.6 mt -62.64 -44.73 95.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.553 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.402 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 20.8 m0 -65.37 -43.78 89.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.859 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -60.2 -29.71 68.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.313 0.578 . . . . 0.0 110.091 172.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -77.9 -26.12 61.02 Favored Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 112.307 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.0 m -96.11 -56.26 2.7 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.96 -49.26 76.25 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.702 0.287 . . . . 0.0 111.597 -175.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -71.05 -21.62 62.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.769 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.25 -35.09 66.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.232 0.539 . . . . 0.0 109.762 174.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.65 7.32 34.09 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.481 176.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 65.82 70.39 0.44 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.463 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -130.3 95.77 3.99 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.293 171.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -84.16 70.87 10.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.615 0.721 . . . . 0.0 109.669 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 31.8 m -95.77 169.48 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.07 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -101.48 104.7 15.64 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.877 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.488 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.4 OUTLIER -111.51 138.49 47.97 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.25 -178.376 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.436 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.4 m-85 -130.0 150.85 51.1 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 175.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.413 ' HB ' HG22 ' A' ' 81' ' ' THR . 6.9 tt -130.75 96.81 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.399 -171.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -149.01 133.38 9.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 80.59 102.72 0.3 Allowed Glycine 0 C--O 1.227 -0.314 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.083 -173.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.619 ' HA ' ' HB ' ' A' ' 77' ' ' THR . 18.9 t -53.85 -28.27 34.85 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.913 0.387 . . . . 0.0 111.924 -174.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.488 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 10.0 p-10 -61.42 -36.84 81.45 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -134.39 141.2 46.77 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.54 137.75 53.01 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 167.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.436 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 10.2 tt -111.81 128.24 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.15 0.5 . . . . 0.0 111.633 -172.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -121.18 117.96 28.45 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.615 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.2 mtm -115.76 133.47 56.0 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.716 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.2 mp -132.51 155.44 48.59 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.751 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -105.86 6.01 31.19 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 167.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -100.59 149.54 23.63 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.883 -177.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -131.36 19.16 4.87 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 175.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.9 t -93.98 -60.37 1.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.725 0.298 . . . . 0.0 110.222 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -99.07 8.26 45.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.937 0.398 . . . . 0.0 110.568 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.403 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -54.79 -38.03 66.79 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.21 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -76.11 -35.42 59.31 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.217 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -58.94 -52.5 65.48 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.406 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.585 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 4.3 tt -60.08 -42.53 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.34 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.496 ' HB3' ' HZ2' ' A' ' 119' ' ' LYS . 4.2 ttpm? -52.51 -54.88 26.62 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.344 0.592 . . . . 0.0 110.912 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.599 ' HA ' HG23 ' A' ' 123' ' ' VAL . 2.6 m-20 -65.17 -31.02 72.0 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.875 -177.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -64.48 -45.1 88.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.62 HD12 HG23 ' A' ' 66' ' ' VAL . 74.5 mt -58.36 -45.19 88.67 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.852 177.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.599 HG23 ' HA ' ' A' ' 120' ' ' ASP . 14.3 m -77.5 -17.51 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.758 0.313 . . . . 0.0 111.539 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -81.1 2.38 27.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 178.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.652 ' HG2' HD13 ' A' ' 80' ' ' ILE . 6.3 tp-100 -68.01 163.32 22.53 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.092 -174.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -66.08 -46.21 78.52 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.208 0.527 . . . . 0.0 109.752 -176.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -70.29 -20.94 63.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.432 174.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.4 m 66.11 167.33 0.21 Allowed 'General case' 0 CA--C 1.534 0.332 0 O-C-N 123.716 0.635 . . . . 0.0 109.296 -167.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.48 146.56 6.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.844 0.354 . . . . 0.0 111.322 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -94.53 112.78 24.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.553 176.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -96.55 112.34 28.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.218 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 65.3 p -95.43 132.16 40.8 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 67.7 mt -99.26 117.51 33.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -175.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.44 ' HB3' ' HG3' ' A' ' 63' ' ' MET . 10.8 tp10 -115.78 150.68 36.52 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.855 0.359 . . . . 0.0 110.54 -177.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 111.11 -81.46 0.29 Allowed Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 111.646 -0.582 . . . . 0.0 111.646 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -130.96 114.21 14.95 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.675 0.274 . . . . 0.0 110.591 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.53 ' HA ' ' HE1' ' A' ' 137' ' ' MET . 0.1 OUTLIER -78.39 117.21 19.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.71 177.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.528 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 23.1 m-85 -94.87 -51.79 0.24 Allowed Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 27.3 Cg_endo -60.02 114.12 1.95 Allowed 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 122.139 1.892 . . . . 0.0 112.825 -174.135 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 72.0 -78.06 0.66 Allowed Glycine 0 C--N 1.333 0.399 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.502 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.325 -0.472 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 -179.259 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 112.109 -0.396 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -68.94 -48.43 63.25 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.124 0.488 . . . . 0.0 110.657 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.613 HG21 ' HB2' ' A' ' 103' ' ' ASP . 16.0 tt -117.42 16.82 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-O 121.866 0.841 . . . . 0.0 109.498 -177.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.48 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 59.4 ttt-85 -59.55 -29.38 67.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.514 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -57.53 -46.5 83.77 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.44 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.1 OUTLIER -56.15 -44.33 79.17 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.702 173.223 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -53.45 -76.38 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -179.059 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.5 -59.83 4.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.485 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.568 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.94 -57.16 10.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.905 -171.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -69.58 -45.06 69.54 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.771 -171.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.532 ' HE2' ' HA ' ' A' ' 11' ' ' MET . 25.4 mmt -63.72 -37.59 87.91 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.1 -50.58 72.68 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.848 0.356 . . . . 0.0 110.394 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.568 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 66.8 mtm180 -57.63 -45.5 85.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.268 -176.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -75.48 -52.23 11.17 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.537 -176.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.53 -15.95 60.33 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -172.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.62 -35.15 65.57 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.14 -42.04 99.41 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.485 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -61.44 -41.82 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.743 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.98 -42.74 94.28 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.5 ' O ' HG13 ' A' ' 24' ' ' ILE . 3.1 tttm -52.99 -52.09 59.47 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.048 176.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.424 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 13.5 m-20 -69.45 -35.63 75.84 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.442 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -56.9 -48.93 77.05 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -62.39 -44.81 95.57 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.12 177.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 20' ' ' LYS . 64.5 mt -59.03 -42.21 85.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.723 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.88 -13.2 59.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.538 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.65 -11.75 61.09 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.48 0.657 . . . . 0.0 109.312 166.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.24 28.1 11.18 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 114.288 171.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -154.07 152.5 30.54 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 169.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' N ' HD22 ' A' ' 29' ' ' LEU . 3.6 mm? . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.43 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.499 HD13 ' HE1' ' A' ' 64' ' ' MET . 0.7 OUTLIER . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.164 0.506 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 45.7 mtm -134.13 136.96 44.2 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 170.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.628 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 61.2 mtt -120.26 118.22 29.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.45 . . . . 0.0 111.185 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.419 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 13.1 m-85 -92.41 102.9 15.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 172.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.527 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 18.6 t -94.22 105.03 16.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.156 -170.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.437 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 47.7 m -77.25 101.4 6.22 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.015 178.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.459 HG13 HG21 ' A' ' 80' ' ' ILE . 42.8 t -101.43 -60.67 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.755 -177.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 t -81.75 -68.07 0.73 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.845 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.558 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 81.88 -10.71 51.15 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -169.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.416 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 8.5 t30 -109.25 133.73 20.69 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -64.5 -17.37 59.39 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.98 2.453 . . . . 0.0 114.702 -169.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.416 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 41.0 p -60.36 112.0 1.78 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.338 0.517 . . . . 0.0 111.221 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.423 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 10.4 pt-20 -57.98 -15.59 9.49 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.872 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -47.16 -54.18 11.25 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.075 175.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -58.5 -55.73 31.22 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.276 -0.874 . . . . 0.0 110.884 -172.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.476 ' HA ' HG23 ' A' ' 80' ' ' ILE . 10.6 t -63.73 -31.87 73.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.592 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.49 -52.95 62.38 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.208 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -58.03 -54.78 43.08 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.046 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.578 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.8 tp -65.32 -42.83 94.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.318 -173.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 86.2 m -68.38 -28.07 66.78 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.675 0.274 . . . . 0.0 110.436 178.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 48.3 t -62.85 -48.76 77.64 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 73.9 mt -58.67 -52.36 66.03 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.098 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.62 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 51.8 m0 -63.13 -29.97 71.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.406 -177.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.26 -60.19 3.73 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.42 -33.11 16.13 Favored Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.25 -0.887 . . . . 0.0 113.671 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.0 m -84.05 -67.89 0.76 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.77 -56.55 13.19 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 112.112 -172.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -76.53 -15.16 59.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.641 -170.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -80.32 -23.87 40.33 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.65 10.6 22.56 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.719 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.0 m120 70.63 24.89 4.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.826 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -71.54 100.07 2.18 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 173.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -85.36 69.86 10.75 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.495 0.664 . . . . 0.0 110.366 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 24.4 m -107.47 159.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.024 179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -100.53 136.93 39.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 176.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.535 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -140.58 135.55 31.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.088 -169.304 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.417 ' O ' HG23 ' A' ' 106' ' ' ILE . 28.4 m-85 -130.46 132.37 45.65 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.587 174.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.473 HD12 HG23 ' A' ' 77' ' ' THR . 6.9 tt -109.69 89.75 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 109.9 179.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -138.24 131.77 41.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.85 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.03 98.47 0.11 Allowed Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 -172.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.423 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 15.0 m -49.29 -27.76 4.14 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.984 0.514 . . . . 0.0 112.315 -174.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.613 ' HB2' HG21 ' A' ' 3' ' ' ILE . 35.7 t70 -47.33 -47.37 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.561 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.527 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 51.0 mtt180 -135.98 147.09 47.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.557 0.694 . . . . 0.0 112.616 -172.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -112.32 122.5 47.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 166.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.721 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.7 tt -98.49 133.63 40.14 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.74 -173.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -126.89 109.63 12.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.504 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.721 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.5 mpp? -96.8 124.57 40.82 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 178.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.419 HD12 HD12 ' A' ' 62' ' ' LEU . 6.0 mp -111.72 102.98 11.24 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.55 -32.88 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 176.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -141.63 126.89 18.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.173 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 167.11 118.4 0.44 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.521 -0.847 . . . . 0.0 113.161 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.5 m -81.25 -18.86 44.52 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -79.57 33.7 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.11 -175.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.432 ' O ' HG21 ' A' ' 118' ' ' ILE . . . -61.95 -59.5 5.02 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.135 0.493 . . . . 0.0 111.857 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -26.94 64.06 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.884 0.373 . . . . 0.0 110.241 -176.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.52 -52.5 52.17 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.368 177.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.572 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 tt -62.57 -39.58 85.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -58.16 -43.16 87.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.12 176.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.558 ' HA ' HG21 ' A' ' 123' ' ' VAL . 27.0 t70 -63.56 -37.48 87.47 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.233 0.539 . . . . 0.0 110.181 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -66.14 -33.06 74.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.829 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.0 mt -68.72 -47.73 65.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.355 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 120' ' ' ASP . 18.9 m -73.58 -8.67 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.2 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -65.32 -0.12 1.68 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.954 171.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.62 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.7 mp0 -101.59 85.94 2.85 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -178.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -55.71 -28.96 58.49 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.492 -175.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.537 ' O ' ' SG ' ' A' ' 128' ' ' CYS . 71.3 mtt85 -61.7 -46.25 90.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.18 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.537 ' SG ' ' O ' ' A' ' 127' ' ' ARG . 97.7 m -168.2 123.47 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -177.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.456 ' HB1' ' HA ' ' A' ' 123' ' ' VAL . . . -164.22 93.64 0.7 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.053 0.454 . . . . 0.0 111.526 -177.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.437 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 40.5 mt-10 -127.04 150.01 49.65 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 172.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.2 p -155.43 142.24 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.855 0.36 . . . . 0.0 111.348 -176.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 41.5 p -126.71 138.19 53.36 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.628 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 6.0 mp -97.68 172.24 7.83 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.569 -0.16 . . . . 0.0 110.569 -175.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.34 86.78 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -177.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 63.01 -79.29 0.03 OUTLIER Glycine 0 CA--C 1.521 0.418 0 N-CA-C 114.786 0.675 . . . . 0.0 114.786 169.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -65.77 123.18 19.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.006 0.432 . . . . 0.0 111.973 -170.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.668 ' HA ' ' HE1' ' A' ' 137' ' ' MET . 5.0 mmt -80.5 105.19 11.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.718 174.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.408 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 4.8 m-85 -67.05 -53.15 27.05 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.553 -175.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 58.8 Cg_endo -70.82 103.74 1.38 Allowed 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.881 1.721 . . . . 0.0 112.612 -177.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 63.71 -114.5 6.91 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.808 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 86.5 tttt . . . . . 0 C--O 1.237 0.419 0 CA-C-O 120.88 0.372 . . . . 0.0 110.479 179.853 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.624 0 N-CA-C 111.876 -0.49 . . . . 0.0 111.876 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -114.66 168.03 10.23 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 3' ' ' ILE . 13.6 tt -137.8 23.1 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.547 0.689 . . . . 0.0 110.279 -176.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.479 ' HA ' HD21 ' A' ' 7' ' ' ASN . 49.6 ttt180 -56.02 -35.22 66.61 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.418 -177.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.23 -43.88 61.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.299 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -62.36 -42.21 99.22 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.883 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.537 ' O ' ' HB2' ' A' ' 11' ' ' MET . 49.0 m-80 -58.87 -66.4 0.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.865 -177.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -51.79 -60.82 2.73 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.454 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.554 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . . . -56.08 -70.95 0.1 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.58 -176.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 2.7 m-20 -60.9 -56.83 16.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.452 -174.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.715 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 10.8 mmt -60.84 -49.63 76.72 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.18 -172.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -64.14 -44.78 91.14 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.582 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.554 ' NH1' ' HA ' ' A' ' 9' ' ' ALA . 54.5 mtt85 -85.78 -1.95 57.74 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.456 ' O ' ' HB3' ' A' ' 17' ' ' GLN . 55.9 tp -95.56 -46.68 6.55 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 171.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.619 HD11 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -76.0 -20.96 57.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.373 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 31.3 tp10 -48.61 -40.54 27.88 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.776 0.798 . . . . 0.0 109.019 170.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 7.9 tt0 -60.26 -58.85 6.74 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 114.304 -1.317 . . . . 0.0 110.336 175.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 47.9 m95 -53.06 -38.45 62.48 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.682 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 43.3 mt-10 -67.52 -44.31 78.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.148 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -60.16 -50.0 75.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.158 177.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -58.03 -36.87 73.34 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 178.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.63 -50.48 72.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.411 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.73 -38.31 89.99 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.052 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.2 mt -63.02 -41.12 91.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.833 0.349 . . . . 0.0 110.546 178.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.44 -23.03 58.86 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.18 0.514 . . . . 0.0 109.883 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -72.19 -17.09 61.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.556 0.693 . . . . 0.0 109.368 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.48 21.29 35.05 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.898 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -132.43 115.83 16.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--N 1.33 -0.274 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.425 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.588 HD12 ' HE1' ' A' ' 64' ' ' MET . 3.3 tm? . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.619 ' SD ' HD11 ' A' ' 15' ' ' LEU . 21.6 ptt? -147.28 131.55 17.47 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.107 167.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.588 ' HE1' HD12 ' A' ' 62' ' ' LEU . 58.9 mtt -118.42 138.43 52.46 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.7 -170.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -103.83 114.31 28.47 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 168.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.548 HG21 HD11 ' A' ' 122' ' ' LEU . 21.6 t -114.39 112.03 38.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 118.007 0.367 . . . . 0.0 110.959 -172.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.645 HG23 ' HB2' ' A' ' 130' ' ' GLU . 7.9 t -98.16 123.81 42.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.06 -60.59 2.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.21 -174.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.7 t -92.8 -57.46 2.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.339 -172.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.61 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 91.25 29.64 12.16 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -168.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.643 ' HB3' ' HG3' ' A' ' 76' ' ' GLU . 10.3 t30 -125.19 132.77 24.39 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 122.858 0.463 . . . . 0.0 110.325 -178.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.4 -17.11 34.9 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.381 2.721 . . . . 0.0 114.406 -173.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 m -81.47 139.37 35.23 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 112.069 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -41.44 -49.24 3.9 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.536 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -39.1 -41.8 0.85 Allowed 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.773 0.671 . . . . 0.0 112.495 -167.688 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.643 ' HG3' ' HB3' ' A' ' 71' ' ' ASN . 9.8 mm-40 -59.74 -70.47 0.16 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.273 -174.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.448 HG22 ' HA ' ' A' ' 102' ' ' SER . 15.2 t -61.73 -38.64 88.67 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.859 0.361 . . . . 0.0 110.648 -178.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -53.67 -62.65 1.52 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.612 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.433 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 51.9 mt-10 -71.41 -38.69 71.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.816 -173.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.458 HD13 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -66.48 -39.94 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.395 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 90.2 m -69.02 -34.54 75.42 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.5 m -57.44 -45.21 84.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.109 174.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.458 HD12 HD13 ' A' ' 80' ' ' ILE . 83.6 mt -61.13 -51.86 67.29 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.225 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.4 m0 -62.25 -27.62 69.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.525 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.475 HE21 ' HB2' ' A' ' 89' ' ' PHE . 1.0 OUTLIER -72.19 -57.74 3.99 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 174.099 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.01 -12.72 7.53 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 115.693 -0.685 . . . . 0.0 113.672 176.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.4 m -95.92 -67.98 0.82 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 117.084 0.442 . . . . 0.0 110.862 174.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.5 mp -66.34 -56.45 11.05 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.713 -172.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.475 ' HB2' HE21 ' A' ' 85' ' ' GLN . 65.0 m-85 -66.13 -26.45 67.45 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.176 -176.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -72.16 -30.29 64.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 0.0 109.657 175.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.0 5.9 24.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.542 175.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 76.32 17.8 1.95 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.333 176.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -78.79 91.87 4.77 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -82.79 71.96 9.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.55 0.69 . . . . 0.0 109.967 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.6 m -88.14 178.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.421 178.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.575 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 4.9 tp60 -109.95 142.1 41.8 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 119.731 -0.787 . . . . 0.0 109.759 171.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.06 134.94 17.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.083 -178.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.426 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 29.5 m-85 -116.87 134.57 54.61 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 175.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -100.02 90.56 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.827 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.39 137.02 46.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.97 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.441 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 75.26 101.97 0.11 Allowed Glycine 0 C--O 1.225 -0.433 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 -169.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.448 ' HA ' HG22 ' A' ' 77' ' ' THR . 15.2 m -60.31 -10.08 4.27 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.61 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 4.1 p-10 -100.46 -4.85 28.03 Favored 'General case' 0 C--O 1.239 0.517 0 O-C-N 121.974 -0.454 . . . . 0.0 111.179 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 75.4 mtt180 -131.89 151.94 51.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.524 0.678 . . . . 0.0 111.831 -173.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.57 136.17 51.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.209 166.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.479 ' CD1' HD22 ' A' ' 15' ' ' LEU . 4.7 tt -112.46 128.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.429 . . . . 0.0 110.809 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -118.02 145.94 44.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.967 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.575 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -141.61 147.62 37.92 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-O 121.472 0.654 . . . . 0.0 110.837 175.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.6 mt -131.93 136.02 47.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.893 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -92.47 -31.2 15.35 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 164.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.14 110.22 22.21 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.942 -1.026 . . . . 0.0 108.361 170.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -113.45 13.42 23.17 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.303 -173.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.4 t -61.55 -20.17 62.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.757 0.313 . . . . 0.0 111.366 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -118.68 19.02 13.32 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.862 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.496 ' HB3' ' HG ' ' A' ' 62' ' ' LEU . . . -62.03 -44.93 95.65 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.01 -176.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -33.88 77.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -174.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -61.16 -46.69 89.49 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.191 0.52 . . . . 0.0 109.745 177.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -62.04 -42.28 94.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.828 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -52.99 -53.56 48.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.114 0.483 . . . . 0.0 110.181 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.429 ' HA ' HG23 ' A' ' 123' ' ' VAL . 0.8 OUTLIER -60.35 -36.44 77.99 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.035 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -65.19 -48.55 73.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 0.0 110.046 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 88.3 mt -53.6 -47.07 70.53 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.459 177.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 120' ' ' ASP . 21.3 m -79.5 -13.74 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.363 -178.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.9 t -74.56 2.28 10.08 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.857 0.361 . . . . 0.0 111.457 175.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -78.26 164.81 24.57 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.019 0.438 . . . . 0.0 111.586 -176.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.9 -63.66 1.07 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.04 -172.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -75.16 -5.28 43.52 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.216 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 45.7 t 61.42 104.41 0.02 OUTLIER 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.318 0.58 . . . . 0.0 109.79 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.62 133.14 45.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.845 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.645 ' HB2' HG23 ' A' ' 67' ' ' THR . 50.3 mm-40 -83.35 113.25 20.6 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.446 HG22 HG23 ' A' ' 66' ' ' VAL . 7.5 p -109.7 134.22 52.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.851 -175.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 22.9 p -122.37 143.24 49.78 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 31.6 mt -107.67 135.23 49.45 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -175.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.63 141.39 29.93 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.94 -127.52 9.22 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.955 -0.458 . . . . 0.0 111.955 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -135.2 145.0 47.27 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 84.7 mtp -73.71 116.1 13.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.535 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.567 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 49.7 p90 -73.27 -31.26 1.38 Allowed Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 176.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.567 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 65.2 Cg_endo -73.02 101.96 1.39 Allowed 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 121.256 1.304 . . . . 0.0 111.495 173.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 115.61 -107.53 1.73 Allowed Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.684 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 95.7 mttt . . . . . 0 C--O 1.235 0.309 0 CA-C-O 120.685 0.278 . . . . 0.0 110.553 -178.128 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.703 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -171.83 -58.93 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.073 0.463 . . . . 0.0 110.609 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.612 HG12 ' HD2' ' A' ' 6' ' ' TYR . 12.8 tt -110.95 4.96 8.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.09 -173.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.558 ' HA ' ' OD1' ' A' ' 7' ' ' ASN . 99.2 mtt180 -58.72 -13.52 6.21 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -177.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.47 -49.84 71.44 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.519 177.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.612 ' HD2' HG12 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -69.68 -37.61 76.71 Favored 'General case' 0 C--N 1.338 0.065 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.626 -178.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.558 ' OD1' ' HA ' ' A' ' 4' ' ' ARG . 14.7 m120 -48.9 -69.24 0.12 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 176.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.24 -68.12 0.22 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.047 -177.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.34 -59.97 4.45 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.665 -171.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 6' ' ' TYR . 23.5 t70 -66.91 -48.17 69.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.741 -170.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.645 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 6.0 mmt -69.98 -47.07 63.74 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.974 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.42 81.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.97 0.414 . . . . 0.0 110.764 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -68.87 -19.51 64.24 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.167 -178.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.18 -52.52 16.17 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 169.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.438 HD23 ' O ' ' A' ' 11' ' ' MET . 4.4 mm? -69.91 -15.08 63.01 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.808 -176.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -48.41 -55.49 10.7 Favored 'General case' 0 C--O 1.247 0.95 0 CA-C-O 121.533 0.682 . . . . 0.0 111.055 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -66.09 -29.59 69.95 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.53 -178.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.465 ' CH2' ' SD ' ' A' ' 108' ' ' MET . 45.2 m95 -64.05 -41.66 97.31 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -57.91 -47.91 81.45 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 24' ' ' ILE . 83.7 tttt -57.23 -40.71 78.11 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.04 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -62.17 -51.64 67.03 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.727 0.299 . . . . 0.0 110.948 -175.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.67 -25.48 60.28 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.745 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -39.67 85.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.767 0.318 . . . . 0.0 110.16 171.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.2 mt -62.5 -37.82 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -65.58 -34.95 79.44 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.922 175.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -71.37 -20.28 62.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.362 0.601 . . . . 0.0 109.68 174.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.05 35.05 7.28 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.796 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -143.82 132.13 22.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 176.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.406 ' N ' HD21 ' A' ' 29' ' ' LEU . 3.4 mm? . . . . . 0 C--O 1.238 0.459 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.415 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.442 HD11 ' HA3' ' A' ' 112' ' ' GLY . 3.0 tt . . . . . 0 C--O 1.235 0.312 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.506 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 22.7 ptp -126.41 124.54 40.41 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.155 -179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.451 ' HG2' ' CD2' ' A' ' 133' ' ' LEU . 55.6 mtt -107.68 118.03 35.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.466 -176.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.426 ' CZ ' HD12 ' A' ' 106' ' ' ILE . 9.5 m-85 -100.49 126.55 46.92 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.408 HG11 ' CH2' ' A' ' 84' ' ' TRP . 25.8 t -113.01 100.72 11.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.856 0.36 . . . . 0.0 110.303 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.614 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 34.5 m -74.31 99.01 3.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.719 175.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.591 HG11 HG22 ' A' ' 80' ' ' ILE . 58.5 t -96.4 -55.94 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.195 0.521 . . . . 0.0 110.634 -175.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.403 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 9.7 m -87.36 -63.3 1.33 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.483 -172.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 82.1 -10.62 52.68 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 -169.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.565 HD22 HG21 ' A' ' 73' ' ' THR . 10.1 t30 -126.52 137.53 30.57 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -55.6 -17.21 16.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.876 3.051 . . . . 0.0 115.261 -171.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.565 HG21 HD22 ' A' ' 71' ' ' ASN . 9.8 p -49.78 100.02 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -31.95 -44.94 0.09 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.928 1.291 . . . . 0.0 113.247 175.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.794 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.1 mptp? -51.58 -48.47 63.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.342 -166.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.403 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 14.7 mm-40 -58.66 -56.71 18.68 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.204 -174.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.496 HG22 ' HA ' ' A' ' 102' ' ' SER . 14.6 t -64.59 -37.13 86.5 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.559 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.91 -55.25 37.3 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.466 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 54.0 mt-10 -58.77 -55.44 35.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.769 -178.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.591 HG22 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -63.26 -47.4 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.499 -172.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.46 HG23 ' HB ' ' A' ' 99' ' ' ILE . 45.0 m -68.88 -31.67 70.77 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.206 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 18.9 t -68.82 -41.23 78.9 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 98.6 mt -61.21 -46.47 90.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.724 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 40.8 m0 -61.65 -36.58 81.19 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.841 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -59.52 -65.95 0.59 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -51.39 -28.73 21.28 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.325 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.8 m -87.82 -61.76 1.65 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.641 0.721 . . . . 0.0 111.923 -178.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.1 -53.68 46.72 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.261 0.553 . . . . 0.0 111.248 -176.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -76.76 -10.81 59.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.533 -171.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -84.92 -33.19 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 172.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.21 2.21 28.78 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.187 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 74.12 20.15 2.8 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.707 175.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -82.86 71.19 9.96 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 171.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.26 82.27 3.74 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.466 0.651 . . . . 0.0 110.665 -176.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.4 m -87.76 175.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.023 174.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.47 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 5.6 tp60 -99.77 120.68 40.12 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.611 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -119.72 125.89 49.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.719 -164.526 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -128.38 113.15 15.21 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.46 ' HB ' HG23 ' A' ' 81' ' ' THR . 6.0 tt -100.27 90.19 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.635 0.731 . . . . 0.0 109.505 175.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.76 125.01 51.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.498 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.01 102.01 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.147 -0.781 . . . . 0.0 111.147 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.496 ' HA ' HG22 ' A' ' 77' ' ' THR . 21.9 m -47.47 -22.14 0.42 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.418 ' HB2' HG22 ' A' ' 3' ' ' ILE . 17.4 t70 -54.34 -60.49 3.28 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.311 177.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -130.02 136.64 49.62 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.074 0.464 . . . . 0.0 111.688 -174.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -107.69 130.61 54.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 172.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.426 HD12 ' CZ ' ' A' ' 65' ' ' PHE . 7.8 tt -109.27 129.46 63.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-O 121.255 0.55 . . . . 0.0 112.267 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -112.7 122.21 47.01 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.188 172.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.465 ' SD ' ' CH2' ' A' ' 18' ' ' TRP . 61.1 mtt -101.16 133.09 46.23 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -110.62 131.65 54.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.653 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -77.5 -46.68 21.7 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 169.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -134.49 131.24 37.8 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.167 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . 0.442 ' HA3' HD11 ' A' ' 62' ' ' LEU . . . -120.26 56.95 0.59 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.99 -173.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.5 m -63.93 -51.17 65.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.284 0.564 . . . . 0.0 109.571 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -83.44 29.69 0.5 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.451 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.64 -49.14 77.44 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.943 0.402 . . . . 0.0 111.706 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -74.7 -23.7 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.951 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -68.43 -52.66 30.22 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.987 0.422 . . . . 0.0 109.895 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.594 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.0 tt -64.85 -40.92 90.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.279 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -58.61 -44.5 89.94 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.92 0.391 . . . . 0.0 110.119 177.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.35 -43.79 83.75 Favored 'General case' 0 C--O 1.239 0.553 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.92 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -63.54 -36.58 84.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.105 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.6 mt -66.31 -45.37 80.56 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.906 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 125' ' ' GLN . 32.9 m -78.52 -12.1 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.367 -178.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.3 t -62.6 2.13 0.31 Allowed 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.724 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -106.85 131.72 53.63 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 122.08 -0.387 . . . . 0.0 111.568 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -66.22 -18.07 65.12 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.909 170.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.454 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 24.2 mmm180 -58.5 -13.61 5.98 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.565 174.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.454 ' HB3' ' O ' ' A' ' 127' ' ' ARG . 49.5 t 78.25 143.7 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.891 0.744 . . . . 0.0 110.824 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.19 99.02 0.62 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.79 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.614 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 5.9 mm-40 -83.34 111.83 19.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 174.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 50.1 t -98.2 121.92 49.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.262 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 p -132.02 122.08 24.93 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.738 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.451 ' CD2' ' HG2' ' A' ' 64' ' ' MET . 21.8 mt -87.56 127.67 35.26 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.506 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 39.9 mm-40 -90.88 102.62 15.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.265 0.555 . . . . 0.0 110.096 176.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 151.98 -178.57 29.16 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.982 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -73.0 99.02 2.63 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 84.2 mtp -70.23 99.29 1.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.441 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.483 ' CG ' ' HD3' ' A' ' 139' ' ' PRO . 26.7 p90 -61.03 -29.21 5.07 Favored Pre-proline 0 CA--C 1.548 0.895 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 178.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.483 ' HD3' ' CG ' ' A' ' 138' ' ' TYR . 31.4 Cg_exo -63.39 -7.22 11.77 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 121.773 1.649 . . . . 0.0 112.688 172.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -149.14 -97.11 0.17 Allowed Glycine 0 C--N 1.333 0.376 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 120.866 0.365 . . . . 0.0 110.421 177.541 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.996 0 N-CA-C 112.227 -0.349 . . . . 0.0 112.227 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -120.66 157.32 29.84 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.358 0.263 . . . . 0.0 110.303 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.1 tt -113.22 -13.21 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-O 120.919 0.39 . . . . 0.0 111.22 -176.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -58.51 -34.04 70.51 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -51.33 -50.87 58.61 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.276 0.56 . . . . 0.0 110.092 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.534 ' HH ' HG22 ' A' ' 100' ' ' VAL . 0.3 OUTLIER -60.14 -48.28 82.39 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.16 177.797 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 11' ' ' MET . 30.1 m-80 -51.73 -66.77 0.33 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.397 -176.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.59 -59.8 4.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.01 -64.76 0.84 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.945 0.403 . . . . 0.0 111.703 -173.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -64.95 -48.88 72.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.315 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' ' HE1' ' A' ' 65' ' ' PHE . 4.3 mmt -65.19 -44.72 87.49 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.897 -175.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.65 -51.07 66.78 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.802 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -62.59 -31.86 72.76 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.63 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.0 tp -76.41 -53.26 8.39 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.844 0.354 . . . . 0.0 111.181 177.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.639 HD13 ' SD ' ' A' ' 63' ' ' MET . 4.3 mm? -68.79 -17.41 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.046 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -60.11 -35.19 74.7 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.013 0.435 . . . . 0.0 109.873 174.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -62.42 -50.04 73.09 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.57 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 33.3 m95 -54.38 -42.71 70.68 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.797 -178.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -56.57 -54.44 45.86 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 173.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.625 ' O ' HG13 ' A' ' 24' ' ' ILE . 77.5 tttt -56.73 -35.65 68.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.358 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -64.01 -55.66 20.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.81 0.338 . . . . 0.0 111.136 -178.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -74.28 -22.52 59.26 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.572 -175.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.512 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 27.6 m-20 -75.59 -28.45 58.93 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 172.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.625 HG13 ' O ' ' A' ' 20' ' ' LYS . 63.6 mt -68.2 -32.62 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -65.58 -35.85 82.03 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.718 172.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.512 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 31.5 mm-40 -55.83 -16.83 5.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.006 0.431 . . . . 0.0 110.683 169.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.05 14.15 55.14 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.001 171.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -138.55 146.54 42.01 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.419 HD13 HG12 ' A' ' 24' ' ' ILE . 3.3 mm? . . . . . 0 C--O 1.236 0.375 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.819 -176.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.1 mt . . . . . 0 C--O 1.237 0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.639 ' SD ' HD13 ' A' ' 15' ' ' LEU . 44.9 mtm -140.09 110.23 6.54 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 174.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.632 ' HG2' HD21 ' A' ' 133' ' ' LEU . 63.0 mtt -110.3 133.04 53.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.401 -171.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.595 ' HE1' ' SD ' ' A' ' 11' ' ' MET . 68.0 m-85 -95.28 134.36 38.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 168.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 20.7 t -126.62 106.95 16.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.477 HG21 ' HB2' ' A' ' 130' ' ' GLU . 3.0 t -91.44 110.69 22.0 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.15 -60.86 2.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.068 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.416 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 10.8 m -71.76 -44.6 63.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.705 -173.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.62 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 69.08 2.96 34.38 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.238 -0.506 . . . . 0.0 111.852 -172.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . 0.531 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 53.3 t30 -126.25 132.26 24.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD2' ' OD1' ' A' ' 71' ' ' ASN . 10.4 Cg_endo -50.79 -16.52 2.45 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 123.556 2.837 . . . . 0.0 113.941 -179.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.8 p -64.74 90.96 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.988 0.423 . . . . 0.0 110.615 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -53.76 -30.57 45.03 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.015 -177.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -40.4 -46.35 2.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.469 0.708 . . . . 0.0 112.515 -178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.416 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 60.8 mm-40 -63.28 -49.95 72.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.455 -177.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.463 ' HA ' HG23 ' A' ' 80' ' ' ILE . 91.8 m -62.82 -34.78 78.03 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.763 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.96 -51.87 67.43 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.501 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.39 -47.21 80.06 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.293 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.523 HD11 HD12 ' A' ' 83' ' ' LEU . 10.9 tp -65.28 -41.78 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.029 -0.269 . . . . 0.0 110.927 -177.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.0 m -64.73 -34.05 77.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.935 0.398 . . . . 0.0 110.409 177.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 t -60.39 -44.48 95.63 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.523 HD12 HD11 ' A' ' 80' ' ' ILE . 84.2 mt -59.01 -44.42 91.69 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.018 175.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.582 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 52.5 m0 -56.64 -38.88 72.75 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.752 179.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -63.96 -56.34 15.87 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.72 -15.65 13.51 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.624 -0.717 . . . . 0.0 114.02 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.3 m -96.37 -65.24 0.98 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.574 0.687 . . . . 0.0 111.337 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.38 -51.57 68.94 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.353 -175.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -72.77 -20.16 61.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -67.54 -36.2 80.53 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 172.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.8 1.72 48.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.408 175.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 67.7 31.53 5.93 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.408 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -77.76 100.74 6.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.159 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -77.38 89.66 3.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.404 0.621 . . . . 0.0 110.617 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.1 m -119.52 157.32 21.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.241 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.57 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.8 tp60 -101.92 103.92 14.6 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.452 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -107.94 135.79 48.73 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.919 -177.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -120.71 121.28 37.92 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.0 tt -92.18 88.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 122.139 0.971 . . . . 0.0 109.268 174.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.534 HG22 ' HH ' ' A' ' 6' ' ' TYR . 7.3 p -145.28 134.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 177.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 99.9 103.06 2.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -166.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.512 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 16.4 m -37.3 -51.32 1.06 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -171.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.62 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.2 p-10 -101.05 -4.78 26.76 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.795 0.331 . . . . 0.0 111.441 -177.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -113.44 126.18 55.05 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.33 -168.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -115.24 130.77 57.0 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 170.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.466 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.9 tt -108.74 146.43 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.832 0.349 . . . . 0.0 111.445 -178.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -132.65 126.96 33.84 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.908 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.474 ' HG3' ' HG2' ' A' ' 63' ' ' MET . 3.6 mpp? -115.35 122.58 46.31 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 174.229 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.433 ' N ' HD13 ' A' ' 109' ' ' LEU . 5.7 mp -109.14 139.63 43.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.566 -178.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -104.2 5.93 35.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.27 0.557 . . . . 0.0 109.782 174.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -137.45 146.73 44.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.388 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -125.01 20.66 6.68 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.36 -174.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.6 m -76.74 -46.38 25.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.411 0.624 . . . . 0.0 110.127 179.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -105.48 22.44 15.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.076 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.29 -49.15 78.75 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.163 0.506 . . . . 0.0 111.611 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -23.83 56.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.115 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.33 -45.21 60.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.643 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.433 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.4 tt -66.26 -39.89 85.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -57.6 -41.01 80.36 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.122 0.487 . . . . 0.0 109.981 173.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.456 ' HA ' HG21 ' A' ' 123' ' ' VAL . 31.2 t70 -63.54 -41.15 98.47 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.587 178.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -62.51 -36.4 82.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.064 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 92.7 mt -66.43 -49.73 65.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.863 178.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.456 HG21 ' HA ' ' A' ' 120' ' ' ASP . 19.3 m -72.05 -13.44 16.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.932 0.396 . . . . 0.0 110.905 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 25.2 t -69.85 2.2 3.64 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.708 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.582 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 73.6 mt-30 -88.23 92.31 9.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.394 0.616 . . . . 0.0 110.192 -178.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -49.28 -40.96 36.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.72 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.433 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 98.1 mtt180 -56.6 -48.23 77.88 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 127' ' ' ARG . 51.3 t 165.8 138.12 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.461 0.475 . . . . 0.0 110.191 -174.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 179.54 110.69 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.495 0.497 . . . . 0.0 110.935 175.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . 0.477 ' HB2' HG21 ' A' ' 67' ' ' THR . 35.9 mt-10 -108.02 116.76 32.55 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 172.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.54 138.25 39.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.871 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.5 m -149.31 153.54 37.64 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.632 HD21 ' HG2' ' A' ' 64' ' ' MET . 70.7 mt -85.92 156.02 20.68 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.647 0.26 . . . . 0.0 110.465 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.583 ' HG2' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -72.38 148.54 45.16 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 175.375 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 77.08 -81.71 1.16 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.238 -0.506 . . . . 0.0 112.791 176.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -141.83 143.8 33.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.944 0.402 . . . . 0.0 110.879 -176.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.591 ' HG3' ' HD2' ' A' ' 139' ' ' PRO . 14.0 tpt -90.53 115.99 28.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.382 177.073 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.624 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 98.9 m-85 -56.15 -52.77 70.12 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.624 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 32.5 Cg_exo -58.45 94.72 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.005 1.803 . . . . 0.0 111.982 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 99.94 26.44 8.44 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.488 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 84.0 tttt . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 120.685 0.279 . . . . 0.0 110.739 177.143 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.827 0 N-CA-C 112.106 -0.398 . . . . 0.0 112.106 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -127.35 -174.79 3.26 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 110.422 177.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.597 HG12 ' HB3' ' A' ' 6' ' ' TYR . 14.0 tt -107.02 23.5 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.95 0.881 . . . . 0.0 109.414 177.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -65.97 -16.89 64.29 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.426 -174.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -57.39 -46.34 83.54 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.597 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.7 OUTLIER -62.6 -47.13 85.15 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.025 174.75 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 11' ' ' MET . 0.9 OUTLIER -54.0 -68.05 0.21 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -178.4 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -50.02 -64.59 0.76 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.255 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 13' ' ' ARG . . . -57.56 -62.53 1.72 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.277 -172.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.52 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 16.6 t70 -64.09 -63.39 1.17 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.56 -174.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.631 ' HA ' ' HE3' ' A' ' 11' ' ' MET . 14.0 mmt -54.75 -55.75 26.57 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.815 0.34 . . . . 0.0 110.846 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.09 -53.78 10.2 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.3 -173.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 9' ' ' ALA . 35.5 mtt180 -80.13 -8.2 59.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.746 -167.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.52 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 52.5 tp -98.96 -52.98 3.4 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 171.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.26 -11.4 60.9 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.584 0.23 . . . . 0.0 111.358 -175.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -48.47 -48.94 37.42 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.18 171.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 11.3 pt20 -57.43 -38.16 73.95 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.382 -175.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.423 ' HB3' ' HE2' ' A' ' 108' ' ' MET . 76.4 m95 -64.63 -39.22 93.32 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.948 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.77 -47.38 85.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.561 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.3 ttpm? -63.32 -33.28 75.17 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.214 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -63.67 -48.37 77.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 109.946 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.77 -37.82 71.62 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.672 175.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 72.7 m-20 -68.43 -40.33 81.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.407 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.561 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.8 mt -62.51 -38.37 81.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 CA-C-O 121.363 0.601 . . . . 0.0 109.662 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -70.91 -28.69 64.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.237 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.439 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 10.0 tp10 -64.29 -12.07 38.05 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.127 172.047 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.13 21.87 34.27 Favored Glycine 0 C--N 1.333 0.381 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.687 173.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -152.03 153.06 33.24 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.184 0.516 . . . . 0.0 111.469 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.168 175.213 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.653 HD12 HD22 ' A' ' 133' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 121.416 0.627 . . . . 0.0 112.468 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' MET . . . . . 0.681 ' SD ' ' HE3' ' A' ' 108' ' ' MET . 35.3 mtp -126.74 148.67 49.87 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.621 ' HE3' ' HB2' ' A' ' 119' ' ' LYS . 62.4 mtt -130.79 118.79 21.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -175.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.46 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 25.1 m-85 -98.95 97.41 8.58 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 171.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.516 HG23 HD12 ' A' ' 122' ' ' LEU . 22.0 t -88.76 110.42 21.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.876 0.369 . . . . 0.0 111.466 -172.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.0 m -74.24 96.04 2.73 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.711 HG12 HG21 ' A' ' 80' ' ' ILE . 46.3 t -90.42 -48.46 14.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.314 0.578 . . . . 0.0 110.775 -174.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.808 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 43.7 t -90.97 -61.04 1.75 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.22 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 75.91 -3.2 52.09 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -168.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -119.78 134.38 23.91 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 109.695 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.16 -17.74 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.66 2.906 . . . . 0.0 114.832 -173.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.47 HG22 ' HD3' ' A' ' 75' ' ' LYS . 1.1 m -78.21 145.39 35.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.311 0.505 . . . . 0.0 110.343 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -85.27 -22.68 28.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -163.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.47 ' HD3' HG22 ' A' ' 73' ' ' THR . 0.0 OUTLIER -47.06 -42.04 17.98 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.503 0.668 . . . . 0.0 110.706 -173.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -65.62 0.57 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.419 -175.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.412 HG22 ' HA ' ' A' ' 102' ' ' SER . 15.3 t -63.73 -37.13 86.19 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.784 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.24 -58.31 9.08 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.136 0.493 . . . . 0.0 110.524 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -60.69 -46.82 88.91 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.433 -177.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.711 HG21 HG12 ' A' ' 68' ' ' VAL . 10.4 tp -68.16 -40.18 82.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.406 -175.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 97.4 m -64.96 -35.96 82.87 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.1 t -62.22 -42.61 99.46 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.983 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.99 -49.02 79.14 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.194 0.521 . . . . 0.0 110.673 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.42 ' HZ3' ' HB2' ' A' ' 105' ' ' ALA . 43.4 m0 -61.16 -41.01 96.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.144 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -55.49 -46.05 76.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 109.881 172.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -68.5 -22.37 74.94 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.747 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 m -96.28 -68.25 0.81 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.924 0.392 . . . . 0.0 111.858 -179.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 88' ' ' LEU . 7.3 mp -63.88 -45.89 87.36 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.85 -172.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -76.82 -0.39 23.78 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.769 0.318 . . . . 0.0 111.542 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -88.29 -36.09 16.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.28 -10.34 59.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.699 171.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 57.7 71.4 0.58 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.636 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -89.17 161.18 16.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.734 175.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -87.32 27.11 1.11 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.058 -177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.551 HG11 ' HG ' ' A' ' 109' ' ' LEU . 29.5 m -86.53 132.94 31.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.298 0.571 . . . . 0.0 111.219 -176.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -99.95 118.71 36.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 173.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.659 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -127.13 140.86 51.96 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.832 -172.106 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -125.77 147.03 49.52 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.492 176.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.4 tt -112.76 98.36 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.538 0.685 . . . . 0.0 109.638 177.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.8 p -149.16 138.66 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.669 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 77.97 102.46 0.19 Allowed Glycine 0 C--O 1.226 -0.363 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.412 ' HA ' HG22 ' A' ' 77' ' ' THR . 14.0 m -49.32 -32.37 11.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -173.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.808 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 10.3 p-10 -74.48 -16.81 60.84 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -177.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 53.9 mtt85 -134.44 156.4 48.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.88 0.848 . . . . 0.0 112.922 -169.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.42 ' HB2' ' HZ3' ' A' ' 84' ' ' TRP . . . -135.77 142.29 44.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 107.703 163.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 4.4 tt -117.15 137.39 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.54 -172.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -131.69 142.27 49.78 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.6 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.681 ' HE3' ' SD ' ' A' ' 63' ' ' MET . 70.6 mtp -127.51 119.65 26.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 177.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.551 ' HG ' HG11 ' A' ' 95' ' ' VAL . 5.0 mp -98.91 119.89 38.43 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.37 -32.65 58.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 175.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -112.64 111.55 22.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.593 169.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -85.3 22.94 8.99 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.309 -0.472 . . . . 0.0 112.642 -178.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -60.57 -49.06 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.993 0.425 . . . . 0.0 110.874 -179.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -97.36 29.96 3.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.735 -178.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.51 ' HB1' ' HG ' ' A' ' 62' ' ' LEU . . . -56.12 -53.01 62.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.732 -178.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -75.54 -22.02 57.41 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.17 -177.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -68.3 -56.04 10.0 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 175.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.646 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.4 tt -59.47 -41.55 84.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.796 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.621 ' HB2' ' HE3' ' A' ' 64' ' ' MET . 65.7 tttm -55.06 -48.58 73.29 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.917 0.389 . . . . 0.0 110.337 177.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.04 -46.64 85.02 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.277 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -61.84 -41.29 97.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.47 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.646 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 78.7 mt -61.58 -41.2 97.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.664 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 27.7 m -87.29 -4.83 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.575 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.3 m -70.48 2.4 4.0 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.51 0.324 . . . . 0.0 111.736 174.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.525 ' NE2' HG12 ' A' ' 80' ' ' ILE . 46.2 mt-30 -59.69 162.93 4.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.404 0.621 . . . . 0.0 111.777 -177.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -85.97 -42.76 13.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.091 -0.959 . . . . 0.0 108.789 176.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -71.04 -22.82 62.09 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.478 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.3 m 72.86 137.39 0.05 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.919 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -137.72 156.08 48.39 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.542 -178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -109.24 130.48 55.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.007 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.427 HG22 HG13 ' A' ' 66' ' ' VAL . 58.2 t -109.22 124.36 65.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.896 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.46 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 40.3 p -102.93 137.38 41.21 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 174.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.653 HD22 HD12 ' A' ' 62' ' ' LEU . 50.1 mt -102.22 149.77 23.97 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.421 -172.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.568 ' HB3' ' HB2' ' A' ' 63' ' ' MET . 3.2 tm-20 -104.65 133.64 49.16 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 114.24 177.77 19.1 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -71.73 120.3 17.13 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' MET . . . . . 0.719 ' HE3' ' HG2' ' A' ' 139' ' ' PRO . 11.0 tpt -56.35 111.26 0.93 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.932 0.396 . . . . 0.0 110.671 -177.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.444 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 43.9 m-85 -74.27 -49.95 5.15 Favored Pre-proline 0 CA--C 1.538 0.516 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.485 -175.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.719 ' HG2' ' HE3' ' A' ' 137' ' ' MET . 92.3 Cg_endo -78.53 171.29 17.02 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.811 1.674 . . . . 0.0 112.08 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -63.26 -56.0 22.69 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 121.148 -0.549 . . . . 0.0 112.208 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.234 0.263 0 C-N-CA 122.568 0.347 . . . . 0.0 110.184 178.32 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.916 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.445 ' HB3' ' HG3' ' A' ' 4' ' ' ARG . 7.0 m-20 -114.01 152.44 30.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.138 0.494 . . . . 0.0 111.026 -176.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 3' ' ' ILE . 12.7 tt -119.15 11.32 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.887 -178.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.445 ' HG3' ' HB3' ' A' ' 2' ' ' ASP . 51.4 mtt180 -58.86 -49.72 76.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.93 -173.023 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -58.52 -42.69 88.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.469 -176.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.29 -48.83 80.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.077 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.606 ' HA ' ' SD ' ' A' ' 11' ' ' MET . 21.9 m-80 -60.38 -69.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.982 -179.097 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -49.53 -66.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.17 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.71 -60.37 3.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.914 -172.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -70.7 -44.54 66.72 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.155 0.502 . . . . 0.0 110.788 -169.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.606 ' SD ' ' HA ' ' A' ' 7' ' ' ASN . 71.0 mtp -74.51 -34.71 63.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.749 -172.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.54 -34.55 76.04 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.859 173.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 -62.8 -39.24 93.66 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.756 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 pp -84.05 -32.04 25.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.035 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.41 HD23 ' O ' ' A' ' 11' ' ' MET . 3.5 mm? -69.28 -22.6 63.8 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.773 0.321 . . . . 0.0 110.273 174.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -48.8 -39.38 25.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.289 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -60.16 -46.32 90.07 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.347 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.463 ' CH2' ' HG3' ' A' ' 108' ' ' MET . 57.9 m95 -60.79 -42.14 96.98 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.179 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.06 -47.36 86.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.564 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.5 tttt -62.99 -34.21 77.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.51 178.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.19 -54.22 48.45 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.453 0.168 . . . . 0.0 111.117 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.41 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.5 p-10 -70.65 -26.71 63.58 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.093 -178.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 11.5 m-20 -62.3 -48.43 79.91 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.071 0.462 . . . . 0.0 110.472 172.069 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 20' ' ' LYS . 80.7 mt -59.66 -40.39 82.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.753 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -67.53 -30.73 70.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.399 178.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 74.3 mm-40 -60.43 -15.37 25.82 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 110.447 171.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.22 34.65 6.63 Favored Glycine 0 C--N 1.333 0.377 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.414 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -158.66 149.76 20.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.758 0.313 . . . . 0.0 110.247 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.433 ' N ' HD21 ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.437 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 32.5 mtm -132.45 128.71 38.06 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 169.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.466 ' HE2' ' O ' ' A' ' 115' ' ' ALA . 60.2 mtt -110.48 122.43 47.7 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.929 0.395 . . . . 0.0 112.049 -171.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -95.62 106.68 18.8 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 169.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 23.3 t -99.67 112.83 33.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.67 0.272 . . . . 0.0 110.768 -174.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.788 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 25.8 m -85.48 109.66 18.64 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.599 HG13 HG21 ' A' ' 80' ' ' ILE . 42.7 t -94.66 -62.97 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 111.641 -171.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 52.8 p -93.6 -48.06 6.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.201 -173.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 77.66 9.24 87.01 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -165.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -126.22 129.22 24.27 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 123.618 0.767 . . . . 0.0 109.342 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.462 ' O ' ' HB3' ' A' ' 102' ' ' SER . 47.8 Cg_endo -65.64 -18.45 58.87 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.18 2.587 . . . . 0.0 114.816 -169.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.439 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.7 m -63.93 123.69 19.61 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.216 0.462 . . . . 0.0 110.944 -175.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -50.66 -29.04 10.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.759 0.824 . . . . 0.0 112.711 -175.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.439 ' HG3' HG22 ' A' ' 73' ' ' THR . 25.2 mtpp -38.06 -60.74 0.72 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.447 0.699 . . . . 0.0 112.702 -176.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.98 -59.07 6.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.738 -171.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.6 t -60.65 -43.03 98.09 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 123.119 0.262 . . . . 0.0 110.999 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.83 -61.91 2.26 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.957 0.408 . . . . 0.0 111.081 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.1 -50.22 74.22 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.053 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.599 HG21 HG13 ' A' ' 68' ' ' VAL . 7.5 tp -64.45 -41.81 93.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.673 -173.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -66.34 -34.37 77.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.692 0.282 . . . . 0.0 110.652 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.492 ' O ' ' HB3' ' A' ' 85' ' ' GLN . 22.7 t -60.8 -43.45 98.14 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.331 0.586 . . . . 0.0 109.545 174.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.2 mt -64.29 -37.25 86.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.161 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . 0.573 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 46.3 m0 -67.11 -29.28 68.98 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.419 178.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.492 ' HB3' ' O ' ' A' ' 82' ' ' SER . 30.8 tt0 -62.51 -55.21 29.67 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.2 -26.95 51.31 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.429 -0.805 . . . . 0.0 113.432 175.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.3 m -86.87 -70.39 0.61 Allowed 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.387 -0.478 . . . . 0.0 111.411 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -53.6 -50.2 66.14 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -173.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.419 ' CD2' ' HA ' ' A' ' 85' ' ' GLN . 57.0 m-85 -77.25 -24.15 51.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -170.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -82.38 -19.97 38.11 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.73 10.41 7.65 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.565 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 74.79 15.1 3.23 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.729 0.812 . . . . 0.0 112.486 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -89.79 153.88 20.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -149.19 77.44 1.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.579 0.704 . . . . 0.0 110.039 176.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 29.4 m -89.36 176.59 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.831 174.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.792 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 5.8 tp60 -100.3 133.77 44.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 173.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.591 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.04 133.28 35.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.93 -164.524 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.421 ' O ' HG22 ' A' ' 106' ' ' ILE . 77.4 m-85 -137.85 132.66 32.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 176.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -89.14 88.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.816 0.817 . . . . 0.0 109.298 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.532 HG13 ' HE3' ' A' ' 11' ' ' MET . 3.6 p -136.96 137.9 46.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.777 -179.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.96 102.09 1.13 Allowed Glycine 0 C--O 1.222 -0.618 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -166.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 15.5 m -46.9 -36.11 7.2 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -101.18 9.84 41.48 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.788 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 86.3 mtt85 -142.96 159.87 41.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.635 0.731 . . . . 0.0 112.34 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.53 144.69 51.57 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.0 168.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 98' ' ' PHE . 13.2 tt -114.76 141.64 30.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 120.999 0.428 . . . . 0.0 111.189 -177.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -135.21 106.87 6.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.165 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.792 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.3 OUTLIER -93.47 121.6 35.03 Favored 'General case' 0 C--O 1.243 0.752 0 CA-C-O 121.339 0.59 . . . . 0.0 110.118 176.12 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.433 HD11 ' N ' ' A' ' 109' ' ' LEU . 5.5 mp -105.45 120.98 42.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.153 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -54.66 15.61 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -112.51 111.4 22.2 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.42 174.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.27 56.6 4.77 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.249 -0.5 . . . . 0.0 113.183 -175.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.6 m -69.05 -29.38 67.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.868 0.366 . . . . 0.0 111.162 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -124.6 29.32 6.3 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.27 0.557 . . . . 0.0 110.905 -177.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.466 ' O ' ' HE2' ' A' ' 64' ' ' MET . . . -58.72 -43.11 90.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.716 -178.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' TRP . . . . . 0.407 ' CH2' ' HG3' ' A' ' 139' ' ' PRO . 16.6 m95 -72.55 -34.43 67.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.724 -175.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.88 -51.29 65.27 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.506 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.1 tt -63.09 -38.64 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 178.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 23.2 ttpp -53.04 -57.99 8.5 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.126 0.488 . . . . 0.0 110.623 176.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.662 ' HA ' HG21 ' A' ' 123' ' ' VAL . 33.2 m-20 -68.18 -26.56 65.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.211 -176.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -65.21 -43.07 92.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.8 mt -72.69 -37.75 67.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.61 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.662 HG21 ' HA ' ' A' ' 120' ' ' ASP . 14.1 m -73.37 -26.03 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.803 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 18.7 t -85.61 3.69 39.66 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.74 176.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.573 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 6.3 tp-100 -65.54 158.64 26.49 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.937 -170.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.7 -68.7 0.28 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.722 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -73.09 4.86 3.87 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.553 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.5 m 71.42 149.54 0.09 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.317 0.647 . . . . 0.0 111.398 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 68' ' ' VAL . . . -171.05 103.76 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.402 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -91.27 130.92 37.08 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.301 0.572 . . . . 0.0 110.515 -179.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 45.5 t -92.01 144.26 9.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.443 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 85.9 m -124.99 136.11 53.42 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 90.6 mt -96.51 125.87 41.3 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 110.573 -174.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -94.89 148.71 22.02 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.52 -115.66 5.27 Favored Glycine 0 N--CA 1.452 -0.268 0 N-CA-C 111.726 -0.55 . . . . 0.0 111.726 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -135.78 124.82 24.31 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 87.7 mtp -76.66 97.96 4.59 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.503 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 49.8 p90 -72.86 -31.71 1.58 Allowed Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 97.0 Cg_endo -76.5 164.65 30.3 Favored 'Trans proline' 0 C--N 1.366 1.471 0 C-N-CA 121.248 1.298 . . . . 0.0 111.814 176.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 107.23 90.65 2.16 Favored Glycine 0 C--N 1.329 0.16 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.57 177.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.582 ' HZ3' ' HB2' ' A' ' 141' ' ' LYS . 4.5 ttmp? . . . . . 0 C--O 1.235 0.336 0 CA-C-O 120.697 0.284 . . . . 0.0 110.31 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.455 HD13 ' HB2' ' A' ' 103' ' ' ASP . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -54.57 -22.68 13.92 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.684 0.278 . . . . 0.0 111.625 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.36 -45.14 88.81 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.518 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -67.95 -40.66 83.2 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.676 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.559 ' O ' ' HB2' ' A' ' 11' ' ' MET . 81.0 m-20 -51.12 -69.05 0.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.641 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -53.49 -64.23 0.89 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.295 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.56 -58.69 4.26 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.302 -172.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.506 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 5.8 m-20 -70.17 -34.69 73.3 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -171.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.559 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 29.8 mmt -68.96 -41.55 77.84 Favored 'General case' 0 C--O 1.227 -0.132 0 C-N-CA 119.691 -0.804 . . . . 0.0 109.243 176.076 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.05 -49.75 68.29 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -66.49 -39.56 88.8 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.298 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.497 HD21 ' HD2' ' A' ' 98' ' ' PHE . 57.4 tp -66.9 -51.46 55.07 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.877 0.37 . . . . 0.0 110.891 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.542 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -69.99 -29.48 66.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.259 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.29 -34.98 66.98 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.061 0.458 . . . . 0.0 110.169 177.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -62.19 -53.02 61.23 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.89 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -57.74 -36.14 71.67 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.987 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -61.5 -50.04 74.3 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.513 ' O ' HG13 ' A' ' 24' ' ' ILE . 31.8 ttmt -65.4 -35.24 80.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.343 -177.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -66.22 -44.93 82.42 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.867 0.365 . . . . 0.0 110.043 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -61.63 -33.5 74.05 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.894 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.27 -42.1 72.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.952 175.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 20' ' ' LYS . 71.5 mt -61.11 -36.6 73.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -70.09 -35.1 73.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.482 175.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.88 -24.63 66.1 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.26 24.36 22.14 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.458 -0.792 . . . . 0.0 114.042 174.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -159.17 156.8 29.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 117.062 0.431 . . . . 0.0 110.454 172.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.371 -178.164 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.4 mt . . . . . 0 N--CA 1.468 0.443 0 CA-C-O 121.385 0.612 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.542 ' SD ' HD12 ' A' ' 15' ' ' LEU . 55.1 mtm -138.12 145.34 41.51 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 170.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.544 ' HG2' HD23 ' A' ' 133' ' ' LEU . 64.3 mtt -128.37 134.2 48.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.886 0.374 . . . . 0.0 111.829 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 134' ' ' GLU . 43.7 m-85 -98.03 121.65 40.21 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 166.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 39.3 t -116.38 104.16 16.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.595 0.236 . . . . 0.0 110.777 -174.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.473 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 86.9 m -72.41 107.66 5.1 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 174.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.757 HG11 HG21 ' A' ' 80' ' ' ILE . 42.3 t -101.09 -62.92 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.718 0.294 . . . . 0.0 111.204 -173.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.7 m -92.62 -45.81 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.867 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.66 10.69 67.71 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.799 -0.921 . . . . 0.0 110.799 -169.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.488 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 30.3 t30 -126.11 129.23 24.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 123.615 0.766 . . . . 0.0 109.096 -177.086 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.488 ' HD2' ' OD1' ' A' ' 71' ' ' ASN . 13.8 Cg_endo -55.15 -18.15 17.02 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.549 2.833 . . . . 0.0 114.225 -176.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 75' ' ' LYS . 24.4 m -58.77 93.06 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.919 0.39 . . . . 0.0 111.611 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.461 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 2.6 mp0 -50.81 -23.66 2.92 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.289 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.58 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -59.61 -41.22 89.88 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.757 -174.727 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.26 -53.53 55.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.679 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.519 ' HA ' HG22 ' A' ' 80' ' ' ILE . 17.5 m -62.77 -32.88 74.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.54 -60.09 4.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.316 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 42.0 mt-10 -55.71 -55.82 27.71 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.575 0.703 . . . . 0.0 110.867 -178.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.757 HG21 HG11 ' A' ' 68' ' ' VAL . 10.7 tp -65.1 -48.93 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.073 -171.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.489 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 89.8 m -63.56 -29.83 71.03 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 122.244 -0.285 . . . . 0.0 110.662 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.3 t -59.41 -46.68 88.04 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.512 HD12 HD12 ' A' ' 80' ' ' ILE . 55.6 mt -58.39 -48.48 80.48 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.092 175.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.512 ' NE1' HG13 ' A' ' 80' ' ' ILE . 28.7 m0 -59.27 -39.45 82.93 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.098 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.5 mt-30 -64.68 -58.06 7.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -53.42 -22.26 15.38 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-N 115.71 -0.677 . . . . 0.0 113.91 176.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -88.39 -61.72 1.65 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 117.453 0.627 . . . . 0.0 111.306 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.58 -47.51 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.808 -173.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.416 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 71.3 m-85 -78.69 1.12 24.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.276 -176.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 48.8 t30 -89.34 -37.6 14.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 177.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.44 2.36 48.03 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.637 176.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.4 t30 60.87 89.32 0.08 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.268 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -114.93 140.44 49.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.531 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.66 66.67 1.08 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 110.408 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.9 m -134.71 163.51 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.832 -177.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -139.96 148.83 42.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 173.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.609 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -133.76 137.58 45.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.523 0.202 . . . . 0.0 110.591 -173.531 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.497 ' HD2' HD21 ' A' ' 14' ' ' LEU . 22.9 m-85 -124.77 136.28 53.72 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.3 tt -109.04 89.95 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.463 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.3 p -132.07 125.37 54.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.254 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.518 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 70.91 100.99 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.126 -174.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.461 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 3.0 m -56.61 -14.88 3.56 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -173.132 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.455 ' HB2' HD13 ' A' ' 3' ' ' ILE . 19.7 t70 -57.57 -51.36 69.78 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 46.2 mtt180 -134.36 132.39 39.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.614 -174.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -96.21 136.95 35.99 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 168.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.628 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.9 tt -105.62 136.95 37.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.131 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.434 ' CZ ' ' HE3' ' A' ' 84' ' ' TRP . 25.3 m-85 -132.09 116.98 17.73 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.022 -176.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.628 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.1 mpp? -100.45 121.03 40.88 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.262 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.451 HD12 ' N ' ' A' ' 109' ' ' LEU . 4.9 mp -104.31 119.74 39.64 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.455 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 19.0 mmm-85 -82.36 -16.17 50.15 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -126.72 126.35 43.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.613 174.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.73 10.53 59.04 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 121.137 -0.554 . . . . 0.0 113.502 -175.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.1 m -63.72 -50.53 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.247 0.524 . . . . 0.0 110.319 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -91.93 24.59 3.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.681 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.28 -53.95 52.43 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.087 0.47 . . . . 0.0 111.313 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -71.71 -17.08 62.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.824 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -74.91 -49.96 18.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.241 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 5.1 tt -62.97 -44.91 99.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -55.15 -45.43 75.68 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.478 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.47 -42.95 93.21 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.351 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.01 -39.27 89.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.623 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 33.5 mt -68.51 -38.12 80.64 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.175 -178.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 18.8 m -84.28 -16.88 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.24 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.1 t -75.53 1.57 13.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.399 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -87.71 160.54 18.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.875 0.369 . . . . 0.0 111.53 -173.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -52.48 -66.8 0.32 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.427 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -71.94 -21.37 61.62 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.894 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.8 m 68.68 134.14 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.167 0.587 . . . . 0.0 111.581 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.441 ' HB3' ' HB3' ' A' ' 122' ' ' LEU . . . -100.65 147.56 25.84 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.423 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.473 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 38.7 mt-10 -99.83 117.72 34.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.113 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 29.9 t -110.01 134.15 53.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.384 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 24.1 p -137.72 145.73 42.88 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.544 HD23 ' HG2' ' A' ' 64' ' ' MET . 79.1 mt -86.51 158.9 19.45 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.636 0.255 . . . . 0.0 110.654 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER . . . . . 0 CA--C 1.535 0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.93 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.792 HG12 ' HB3' ' A' ' 6' ' ' TYR . 13.6 tt . . . . . 0 CA--C 1.542 0.651 0 CA-C-O 122.028 0.918 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.518 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 72.0 ttt-85 -63.75 -24.11 67.63 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.006 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.21 -42.55 99.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.362 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.792 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -57.94 -47.06 84.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.374 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.527 ' O ' ' HB2' ' A' ' 11' ' ' MET . 22.2 m-80 -47.52 -70.63 0.09 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.311 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.56 -61.95 2.13 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.996 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -57.24 -68.94 0.18 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.466 -174.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 4.5 m-20 -61.3 -48.69 80.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.257 -0.402 . . . . 0.0 112.07 -173.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.536 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 7.5 mmt -59.67 -46.38 89.22 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.273 -175.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.22 80.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.006 0.431 . . . . 0.0 111.251 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 86.8 mtt180 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.255 -174.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 15' ' ' LEU . 4.4 pp -89.25 -29.57 19.13 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.369 175.074 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.1 OUTLIER -63.71 -30.94 71.98 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 175.469 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -48.16 -42.06 28.54 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.914 177.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -62.1 -52.54 63.45 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.403 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.522 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 48.0 m95 -62.35 -39.4 92.98 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.376 -176.147 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.69 -48.22 80.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.654 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.535 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.3 tttt -62.11 -48.0 82.13 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.032 -178.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -44.93 86.93 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.132 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -57.6 -45.14 85.66 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.073 0.463 . . . . 0.0 110.04 176.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -62.2 -41.52 98.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.954 177.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 20' ' ' LYS . 91.1 mt -60.59 -40.86 85.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.196 0.522 . . . . 0.0 109.999 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -67.19 -31.61 72.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.813 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.33 -10.65 17.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.324 0.583 . . . . 0.0 110.198 172.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.93 33.02 7.57 Favored Glycine 0 CA--C 1.518 0.227 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.991 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -159.46 147.23 17.27 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 171.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.8 mm? . . . . . 0 C--O 1.235 0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.013 -175.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.626 HD11 HD22 ' A' ' 133' ' ' LEU . 44.2 tp . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.498 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 79.8 mtp -135.08 135.11 40.98 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 166.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.527 ' SD ' HD11 ' A' ' 109' ' ' LEU . 86.9 mtp -115.84 119.38 35.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.845 0.355 . . . . 0.0 111.397 -171.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 49.6 m-85 -95.16 123.18 38.52 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.454 HG21 HD13 ' A' ' 122' ' ' LEU . 43.2 t -124.04 109.06 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 117.794 0.27 . . . . 0.0 110.939 -173.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.466 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 28.3 m -74.0 98.49 3.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.641 HG11 HG21 ' A' ' 80' ' ' ILE . 11.4 t -87.63 -58.42 3.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.296 -171.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.614 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 34.7 t -89.92 -58.87 2.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.993 -174.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 88.41 -10.76 70.27 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.444 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 29.1 t-20 -122.98 132.62 24.27 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.938 0.495 . . . . 0.0 109.7 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 49.4 Cg_exo -56.99 -16.17 19.76 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.139 3.226 . . . . 0.0 115.639 -172.149 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 p -52.26 110.68 0.52 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.467 0.576 . . . . 0.0 112.16 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 35.8 mt-10 -55.15 -23.95 23.99 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.715 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -42.39 -62.45 0.96 Allowed 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.006 176.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.408 ' O ' HG22 ' A' ' 80' ' ' ILE . 9.5 mm-40 -56.67 -55.46 33.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.195 -172.199 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 102' ' ' SER . 11.5 t -63.6 -46.18 86.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.694 -173.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.401 ' N ' HG23 ' A' ' 77' ' ' THR . 37.3 tt0 -61.05 -49.35 77.72 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.886 0.375 . . . . 0.0 110.182 -177.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -62.62 -52.79 61.97 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.475 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.641 HG21 HG11 ' A' ' 68' ' ' VAL . 10.9 tp -67.16 -41.73 87.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.228 -174.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.9 m -66.53 -31.04 71.5 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.673 0.273 . . . . 0.0 110.536 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -63.64 -46.52 85.32 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.8 mt -59.66 -37.5 78.91 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.35 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.402 ' HH2' HG22 ' A' ' 68' ' ' VAL . 48.6 m0 -64.4 -44.35 91.56 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.484 177.149 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.51 -59.53 4.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.57 -62.16 4.2 Favored Glycine 0 CA--C 1.522 0.477 0 CA-C-N 115.806 -0.633 . . . . 0.0 113.139 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.1 m -58.84 -57.34 13.47 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.36 -46.69 89.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.929 0.395 . . . . 0.0 111.458 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -72.35 -27.84 62.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.125 -177.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -75.7 -28.19 58.53 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 110.064 177.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 3.63 51.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.287 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.3 t30 62.76 75.94 0.38 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.672 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -107.67 122.17 46.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.086 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -81.24 26.49 0.45 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.227 0.537 . . . . 0.0 110.617 -176.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 m -92.05 157.44 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.906 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -112.85 154.97 25.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.407 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -146.95 138.15 24.05 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.553 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -122.11 151.5 40.85 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.867 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -121.14 90.2 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.636 0.731 . . . . 0.0 110.697 -175.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.9 p -128.82 129.64 68.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 174.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.415 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 80.67 101.32 0.32 Allowed Glycine 0 C--O 1.226 -0.378 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -170.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.5 ' O ' ' HB ' ' A' ' 77' ' ' THR . 15.3 m -62.55 -9.11 7.67 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -169.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.614 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 16.1 p-10 -96.42 -18.98 19.52 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 122.113 -0.367 . . . . 0.0 111.335 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.493 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 49.9 ttt180 -137.88 132.27 32.24 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.983 -172.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.22 153.51 22.04 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.423 HG23 ' HE1' ' A' ' 108' ' ' MET . 11.3 tt -124.93 136.27 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 120.844 0.354 . . . . 0.0 111.269 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 64' ' ' MET . 13.4 m-85 -117.96 139.02 51.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.751 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.522 ' HG2' ' CH2' ' A' ' 18' ' ' TRP . 1.5 mpt? -109.96 115.92 30.67 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.604 178.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.56 HD12 HD23 ' A' ' 62' ' ' LEU . 15.4 mt -126.23 103.4 7.66 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.495 0.497 . . . . 0.0 111.502 -174.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mtp-105 -99.26 5.61 46.57 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 122.076 0.941 . . . . 0.0 108.502 165.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -146.85 124.09 11.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.026 -1.443 . . . . 0.0 107.674 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.63 57.17 0.25 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 119.805 -1.188 . . . . 0.0 113.808 -173.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.4 t -66.36 -25.97 67.05 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -96.79 24.02 6.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.373 177.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.32 -49.94 72.86 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.204 0.526 . . . . 0.0 111.321 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.509 ' HH2' HD11 ' A' ' 133' ' ' LEU . 0.6 OUTLIER -76.62 -26.88 55.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.762 -179.208 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.06 -48.73 75.1 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 120.886 0.374 . . . . 0.0 110.297 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.62 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 15.0 tt -67.33 -39.02 81.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 177.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -55.13 -46.6 75.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.457 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.5 ' HA ' HG22 ' A' ' 123' ' ' VAL . 37.5 m-20 -61.95 -41.37 97.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.471 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -59.66 -38.44 81.46 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.099 0.476 . . . . 0.0 110.399 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 70.9 mt -69.82 -47.81 61.39 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.5 HG22 ' HA ' ' A' ' 120' ' ' ASP . 24.9 m -73.28 -18.72 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.718 0.294 . . . . 0.0 111.476 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 24.7 t -71.53 0.91 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.498 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -76.87 162.85 27.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.74 0.781 . . . . 0.0 112.715 -174.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.65 8.79 1.3 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.345 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 80.9 mtt-85 -121.14 -18.26 7.5 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 122.373 0.269 . . . . 0.0 110.882 -171.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 52.9 t 57.59 71.75 0.56 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.357 0.599 . . . . 0.0 109.984 -172.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.52 130.21 39.6 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.028 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.466 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 42.7 mt-10 -81.26 114.04 19.79 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.252 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.3 t -95.53 128.08 47.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.5 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 33.8 p -133.08 145.28 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.626 HD22 HD11 ' A' ' 62' ' ' LEU . 60.7 mt -102.13 168.87 9.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 110.978 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.557 ' HA ' ' HE2' ' A' ' 65' ' ' PHE . 36.1 tt0 . . . . . 0 C--O 1.234 0.289 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.141 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.502 HD11 ' HA2' ' A' ' 101' ' ' GLY . 12.8 tt . . . . . 0 CA--C 1.537 0.467 0 CA-C-O 121.579 0.704 . . . . 0.0 109.988 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -57.96 -31.61 67.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.009 -176.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.45 -50.34 71.97 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.976 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.02 -47.17 86.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.993 176.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.58 ' O ' ' HB2' ' A' ' 11' ' ' MET . 13.7 m120 -52.34 -74.93 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.961 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -51.65 -66.34 0.4 Allowed 'General case' 0 C--O 1.24 0.595 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -57.34 8.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.885 -169.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -76.26 -37.76 57.15 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.111 -168.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.58 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 11.1 mmt -67.79 -40.86 83.88 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 120.156 -0.618 . . . . 0.0 109.728 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.9 -52.28 66.14 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 121.212 0.53 . . . . 0.0 110.158 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.42 -32.37 73.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.858 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.7 tp -77.38 -52.52 9.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.819 0.343 . . . . 0.0 110.801 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.407 HD21 ' CD1' ' A' ' 106' ' ' ILE . 3.5 mm? -77.05 -10.23 59.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.995 -177.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -47.98 -53.78 15.0 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.996 175.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.18 -37.73 88.53 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.254 -177.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -61.22 -42.17 98.13 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.028 0.442 . . . . 0.0 110.764 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -69.52 -41.24 76.29 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.498 ' O ' HG13 ' A' ' 24' ' ' ILE . 59.1 tttp -54.15 -50.36 67.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.093 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.2 -54.39 47.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.01 178.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.95 -41.71 64.76 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.176 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -65.93 -44.97 83.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.644 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.4 mt -61.98 -34.69 64.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 120.856 0.36 . . . . 0.0 110.39 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -69.13 -38.74 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.308 177.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.49 -21.32 66.25 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.369 0.604 . . . . 0.0 109.658 170.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.98 17.78 46.22 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.304 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -113.8 109.14 18.07 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 176.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.455 HD13 HG12 ' A' ' 24' ' ' ILE . 3.8 mm? . . . . . 0 C--N 1.329 -0.298 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 175.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 109' ' ' LEU . 1.5 tm? . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 121.378 0.609 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.474 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 8.8 ptm -147.19 113.58 5.94 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.225 174.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.574 ' HE2' HD21 ' A' ' 62' ' ' LEU . 62.5 mtt -117.42 141.29 48.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.815 -170.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.481 ' HE2' ' HG2' ' A' ' 134' ' ' GLU . 51.9 m-85 -107.03 122.08 45.75 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 168.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 t -110.62 102.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 110.933 -174.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.726 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 37.1 m -77.15 100.34 5.72 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 172.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.467 HG11 HG21 ' A' ' 80' ' ' ILE . 50.4 t -80.34 -63.64 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.153 -171.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.534 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 38.7 t -93.24 -55.39 3.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.127 0.489 . . . . 0.0 112.233 -172.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.612 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 90.86 -10.27 75.39 Favored Glycine 0 N--CA 1.451 -0.329 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 -167.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.505 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 34.6 t30 -107.79 126.61 29.46 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 176.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.567 ' O ' ' HB2' ' A' ' 102' ' ' SER . 19.0 Cg_endo -56.62 -16.45 19.12 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.6 2.867 . . . . 0.0 114.42 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.681 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.1 m -61.66 95.61 0.05 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.291 0.567 . . . . 0.0 110.468 -177.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -44.94 -31.01 1.12 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.571 1.148 . . . . 0.0 113.918 -172.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.681 ' HG3' HG22 ' A' ' 73' ' ' THR . 0.0 OUTLIER -51.76 -34.61 40.2 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -175.598 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.612 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 5.6 mm-40 -58.23 -55.66 32.17 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.02 0.438 . . . . 0.0 111.023 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.6 m -65.21 -34.73 79.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.923 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.62 -51.65 68.48 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.722 0.296 . . . . 0.0 110.341 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 50.3 mt-10 -55.79 -54.11 48.47 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.33 0.586 . . . . 0.0 110.079 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.488 HD12 HD12 ' A' ' 83' ' ' LEU . 2.6 tp -62.15 -42.36 94.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.146 -172.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 72.6 m -64.67 -39.2 93.27 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.629 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.2 m -62.66 -40.28 96.56 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 120.838 0.351 . . . . 0.0 110.339 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.488 HD12 HD12 ' A' ' 80' ' ' ILE . 86.6 mt -60.89 -50.09 74.81 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 53.9 m0 -60.61 -31.7 70.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.036 -178.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.582 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 35.3 tt0 -62.75 -63.36 1.24 Allowed 'General case' 0 C--O 1.235 0.327 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 173.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.49 -13.68 24.22 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.634 -0.712 . . . . 0.0 114.025 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -96.55 -71.36 0.68 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.376 0.588 . . . . 0.0 111.743 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 9.4 mp -56.42 -54.96 39.48 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.342 -174.078 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.582 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 91.8 m-85 -72.02 -14.32 61.85 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.358 -173.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -78.62 -32.7 47.58 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.46 11.74 22.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.672 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 72.65 25.7 2.56 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.359 0.664 . . . . 0.0 112.638 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 27.7 m-85 -81.99 81.77 7.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.445 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.64 82.49 3.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.239 0.542 . . . . 0.0 109.922 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.839 HG12 HD21 ' A' ' 109' ' ' LEU . 4.3 m -109.14 165.56 5.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.365 -177.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -101.5 136.54 41.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 174.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.623 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.33 142.22 23.83 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -172.805 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -127.27 127.74 44.86 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.6 tt -87.4 88.0 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 122.071 0.939 . . . . 0.0 109.125 173.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.78 134.58 38.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.119 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.502 ' HA2' HD11 ' A' ' 3' ' ' ILE . . . 100.4 104.7 2.67 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.567 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 11.1 p -38.23 -51.92 1.47 Allowed 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -173.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.612 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 10.1 p-10 -102.11 8.16 40.83 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.726 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 54.4 mtt180 -137.04 140.8 42.31 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.58 143.85 46.5 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.641 173.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.645 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.7 tt -112.34 139.56 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.741 0.305 . . . . 0.0 111.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -128.77 139.85 52.0 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.781 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.645 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.3 mpp? -135.14 143.19 46.4 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.049 0.452 . . . . 0.0 110.517 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.839 HD21 HG12 ' A' ' 95' ' ' VAL . 12.4 mt -138.44 151.98 47.92 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.366 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 110' ' ' ARG . 7.3 mmm180 -85.35 -33.02 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.589 176.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -112.73 152.9 28.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.163 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -118.34 27.39 7.33 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 121.273 -0.489 . . . . 0.0 112.474 -178.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -66.02 -69.25 0.31 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.019 0.438 . . . . 0.0 110.693 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.02 25.71 1.1 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.329 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.76 92.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.824 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -77.52 -31.29 53.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.362 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -67.45 -50.84 57.44 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.215 177.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 7.6 tt -62.72 -37.9 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.344 -0.389 . . . . 0.0 109.985 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.478 ' HD3' ' N ' ' A' ' 120' ' ' ASP . 12.2 tmtt? -56.48 -51.64 67.69 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.293 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.482 ' HA ' HG22 ' A' ' 123' ' ' VAL . 64.9 m-20 -62.15 -33.37 74.37 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.668 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -67.58 -42.79 81.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 94.5 mt -61.08 -41.65 97.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.482 HG22 ' HA ' ' A' ' 120' ' ' ASP . 20.6 m -79.06 -15.91 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.515 0.197 . . . . 0.0 111.246 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.5 t -64.87 2.17 0.76 Allowed 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.539 ' HB2' ' HB2' ' A' ' 129' ' ' ALA . 1.2 mp0 -84.87 98.84 10.55 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.349 0.595 . . . . 0.0 110.174 -176.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -45.97 -51.24 13.73 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.467 -1.242 . . . . 0.0 113.582 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 30.9 mtm180 -55.79 -44.65 77.97 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.71 0.29 . . . . 0.0 111.482 -174.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 69' ' ' SER . 21.5 p 177.07 136.0 0.06 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.779 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 125' ' ' GLN . . . -170.93 116.98 0.46 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.75 0.309 . . . . 0.0 111.171 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -137.03 127.61 26.89 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 10.8 p -123.9 143.97 35.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 0.0 110.773 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 53.6 m -131.53 144.98 51.52 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 177.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.449 HD23 ' HG2' ' A' ' 64' ' ' MET . 64.1 mt -93.58 145.5 24.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.481 ' HG2' ' HE2' ' A' ' 65' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.626 HG21 ' HB3' ' A' ' 103' ' ' ASP . 12.1 tt . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 121.61 0.719 . . . . 0.0 110.657 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 60.7 mtt85 -109.58 -37.13 5.78 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.499 -175.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -56.31 -43.58 79.06 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.736 -178.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.448 ' HE1' HG13 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -55.21 -47.11 75.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.441 176.731 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.606 ' O ' ' HB2' ' A' ' 11' ' ' MET . 44.1 m-80 -60.88 -64.54 0.92 Allowed 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -50.36 -69.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.683 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.45 ' HB1' ' NH1' ' A' ' 13' ' ' ARG . . . -59.38 -64.4 0.96 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.042 -174.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.73 -46.49 65.81 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.863 -167.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.606 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 22.3 mmt -70.54 -38.51 74.22 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.938 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.32 -47.12 77.66 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.417 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.45 ' NH1' ' HB1' ' A' ' 9' ' ' ALA . 80.3 mtt180 -70.3 -26.79 63.95 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.885 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.6 tp -82.77 -52.28 6.9 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.907 176.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 4.1 mm? -73.1 -17.25 61.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.986 -174.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.5 OUTLIER -57.47 -32.97 67.5 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.102 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.96 -45.76 84.39 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.806 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -63.29 -41.21 98.96 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.912 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 46.5 mt-10 -63.02 -43.13 99.59 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.394 0.616 . . . . 0.0 109.381 176.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 24' ' ' ILE . 26.4 ttpt -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.12 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -59.07 -44.93 91.92 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.319 0.58 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.5 -37.24 86.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.32 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.33 -37.53 80.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.945 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 20' ' ' LYS . 85.8 mt -62.17 -38.53 81.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 174.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.87 -36.34 82.97 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.898 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -63.02 -15.07 55.17 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.738 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.99 24.77 26.4 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.682 177.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -134.7 132.0 38.33 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.406 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.5 mm? . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.574 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 C--O 1.235 0.302 0 CA-C-O 121.208 0.528 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 21.4 ptm -132.03 110.23 10.58 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.675 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 56.8 mtt -114.73 122.15 45.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.721 -169.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -88.38 117.83 27.57 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 168.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.532 HG21 HD13 ' A' ' 122' ' ' LEU . 39.5 t -114.43 104.75 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.588 0.232 . . . . 0.0 110.954 -173.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.732 HG23 ' HB2' ' A' ' 130' ' ' GLU . 1.6 t -84.96 122.37 29.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -85.35 -61.58 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.302 -174.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 30.9 t -92.88 -36.38 12.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.145 0.498 . . . . 0.0 111.127 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.94 7.52 77.61 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -168.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.406 ' ND2' ' HD2' ' A' ' 72' ' ' PRO . 26.0 t-20 -126.63 139.98 36.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 114.66 -0.77 . . . . 0.0 109.802 -176.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.406 ' HD2' ' ND2' ' A' ' 71' ' ' ASN . 7.4 Cg_endo -47.51 -16.23 0.41 Allowed 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.632 3.555 . . . . 0.0 116.586 -174.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.5 p -76.73 160.28 29.46 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.501 1.046 . . . . 0.0 110.869 -169.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.605 ' HG2' ' HG3' ' A' ' 78' ' ' GLU . 37.5 tt0 -104.08 -25.38 12.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.646 -166.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.754 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.58 -52.74 53.75 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.678 -171.181 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -45.37 -58.89 2.99 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.283 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.473 ' HA ' HG22 ' A' ' 80' ' ' ILE . 35.5 m -67.13 -35.97 80.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.856 -174.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.605 ' HG3' ' HG2' ' A' ' 74' ' ' GLU . 49.1 mt-10 -56.05 -60.17 3.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.09 176.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.431 ' O ' HD13 ' A' ' 83' ' ' LEU . 44.0 mt-10 -59.08 -54.02 51.82 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.899 -175.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.823 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.9 tp -62.36 -42.76 96.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.938 -174.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 91.7 m -64.0 -33.18 75.15 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.457 0.17 . . . . 0.0 111.063 176.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.1 m -63.04 -39.07 93.65 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 110.294 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 79' ' ' GLU . 10.4 mp -67.75 -48.28 66.86 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.539 174.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 43.7 m0 -55.87 -55.94 26.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.968 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -57.33 -54.81 42.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.61 -29.16 3.93 Favored Glycine 0 C--N 1.333 0.393 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.273 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.6 m -91.79 -57.1 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 117.527 0.664 . . . . 0.0 111.284 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.88 -48.62 79.3 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.667 -174.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -74.31 -22.49 59.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.979 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -73.62 -29.41 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.15 0.5 51.51 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.128 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 66.43 36.59 5.06 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.193 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -81.47 119.75 24.13 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -84.75 49.94 1.81 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.245 0.545 . . . . 0.0 111.199 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.99 150.21 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.433 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -102.49 144.98 30.23 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.489 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -146.42 137.92 24.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.147 -177.117 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -127.45 123.14 35.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 175.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -93.74 88.12 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.997 0.903 . . . . 0.0 109.337 173.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.448 HG13 ' HE1' ' A' ' 6' ' ' TYR . 7.0 p -131.53 143.39 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.093 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.2 85.74 0.14 Allowed Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.9 m -30.21 -44.27 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -167.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.626 ' HB3' HG21 ' A' ' 3' ' ' ILE . 13.2 t70 -69.18 -32.81 72.38 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -172.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 93.0 mtt180 -122.46 134.17 54.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.296 0.57 . . . . 0.0 112.323 -171.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -102.65 132.68 48.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 170.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.532 HD12 ' SD ' ' A' ' 11' ' ' MET . 9.3 tt -104.65 129.68 56.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.041 0.448 . . . . 0.0 111.197 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -115.2 132.38 56.63 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.613 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -131.27 136.52 48.25 Favored 'General case' 0 C--O 1.244 0.798 0 CA-C-O 121.366 0.603 . . . . 0.0 110.993 177.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.491 HD21 HD12 ' A' ' 118' ' ' ILE . 4.6 mp -123.11 156.13 35.59 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.871 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -105.09 5.72 32.65 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -135.35 151.75 50.8 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.493 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -127.58 41.53 1.58 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.054 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.8 m -93.6 -65.53 0.99 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.055 0.455 . . . . 0.0 110.113 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 41.4 p90 -91.0 27.6 1.79 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.021 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.61 -48.1 73.4 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.74 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -30.88 69.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.202 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.426 ' HB3' ' O ' ' A' ' 114' ' ' TYR . 5.1 tp10 -52.91 -49.71 65.39 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 172.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.619 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 25.1 mt -64.46 -45.41 95.86 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.126 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -58.17 7.32 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.317 0.58 . . . . 0.0 110.072 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.508 ' O ' ' HB2' ' A' ' 124' ' ' SER . 11.2 m-20 -61.38 -36.85 81.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.791 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -63.36 -47.16 83.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.738 0.304 . . . . 0.0 110.381 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.5 mt -57.81 -45.9 85.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.815 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.525 HG12 ' O ' ' A' ' 129' ' ' ALA . 13.1 m -84.97 -6.75 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -177.091 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 23.2 t -68.65 0.99 3.54 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.135 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.823 ' HG2' HD11 ' A' ' 80' ' ' ILE . 3.2 mp0 -96.04 155.7 16.65 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.602 -0.686 . . . . 0.0 110.633 -174.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -51.59 -51.68 53.56 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.873 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -67.18 -10.12 47.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.483 179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 63.4 m 66.08 -156.62 0.26 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.906 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.525 ' O ' HG12 ' A' ' 123' ' ' VAL . . . 173.23 126.77 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.732 ' HB2' HG23 ' A' ' 67' ' ' THR . 46.0 mt-10 -96.97 113.66 25.21 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.339 0.59 . . . . 0.0 110.331 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.9 t -98.99 135.94 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.282 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.4 m -127.1 112.75 15.54 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.675 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.6 mp -89.95 128.03 36.15 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 . . . . . 0 C--N 1.325 -0.46 0 CA-C-O 120.866 0.365 . . . . 0.0 110.109 176.982 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.4 tt . . . . . 0 C--O 1.236 0.374 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -52.25 -36.41 52.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.304 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.6 -49.9 75.8 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.008 0.433 . . . . 0.0 110.4 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.4 -48.09 76.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.662 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.08 -62.01 1.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.635 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -57.71 -56.91 15.77 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.281 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.93 -61.48 2.58 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.586 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.91 -54.87 41.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.162 -174.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.471 ' O ' HD23 ' A' ' 15' ' ' LEU . 6.2 mmt -58.01 -52.39 65.72 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-O 120.599 0.238 . . . . 0.0 110.904 -176.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.55 -50.18 74.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.019 0.438 . . . . 0.0 111.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -77.41 -12.11 59.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.142 -0.481 . . . . 0.0 112.095 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.2 tp -79.96 -52.15 8.2 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.387 0.613 . . . . 0.0 109.572 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.7 -15.31 62.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.72 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.49 -43.41 45.26 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.572 0.701 . . . . 0.0 109.724 171.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -61.76 -45.65 93.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.454 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.449 ' CZ3' ' HG3' ' A' ' 108' ' ' MET . 28.4 m95 -62.26 -37.43 85.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -60.49 -43.5 96.94 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.053 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.9 tttt -61.43 -50.76 71.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.458 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.11 -46.71 79.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.792 0.329 . . . . 0.0 111.469 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -57.44 -48.69 78.48 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.369 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 28.9 t70 -71.62 -28.88 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 20' ' ' LYS . 50.4 mt -64.42 -42.51 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -69.98 -26.95 64.33 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.03 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.423 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 8.4 tp10 -60.44 -18.32 50.3 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.642 0.734 . . . . 0.0 109.264 169.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.14 35.26 6.38 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.84 172.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -156.48 141.84 17.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' N ' HD12 ' A' ' 29' ' ' LEU . 7.0 mp . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.492 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 109' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 121.238 0.542 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.764 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 28.9 mtp -138.74 132.17 30.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.723 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 63.4 mtt -116.88 125.21 51.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.225 0.536 . . . . 0.0 112.147 -170.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.581 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 72.2 m-85 -95.17 121.63 37.01 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 168.057 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.511 HG21 HD13 ' A' ' 122' ' ' LEU . 40.6 t -117.02 105.59 18.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.755 0.312 . . . . 0.0 110.614 -174.136 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.2 m -79.37 98.42 6.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.496 HG11 HG21 ' A' ' 80' ' ' ILE . 25.2 t -79.64 -60.33 2.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.727 -172.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' A' ' 71' ' ' ASN . 39.9 t -92.62 -57.03 2.8 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.015 -173.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.735 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 82.12 11.52 82.29 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 -167.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.482 ' ND2' ' HD2' ' A' ' 72' ' ' PRO . 26.0 t-20 -125.99 136.07 27.96 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 123.15 0.58 . . . . 0.0 109.709 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.482 ' HD2' ' ND2' ' A' ' 71' ' ' ASN . 30.3 Cg_endo -59.99 -16.89 41.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.886 3.057 . . . . 0.0 116.382 -168.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.7 p -69.65 172.18 7.85 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.27 0.941 . . . . 0.0 112.144 -173.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.91 -22.62 14.29 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.41 -167.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.607 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 10.8 mptt -60.65 -51.89 67.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.601 -170.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.522 ' HG2' ' H ' ' A' ' 77' ' ' THR . 1.6 pm0 -47.57 -62.58 1.37 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.721 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.522 ' H ' ' HG2' ' A' ' 76' ' ' GLU . 14.2 t -60.96 -43.9 98.06 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.48 0.181 . . . . 0.0 110.904 -174.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -57.4 -60.87 3.0 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.165 0.507 . . . . 0.0 110.881 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 37.6 mt-10 -67.73 -37.85 82.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.701 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.496 HG21 HG11 ' A' ' 68' ' ' VAL . 9.8 tp -70.09 -39.76 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.444 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.5 m -64.87 -38.03 89.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.608 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.4 p -67.47 -34.86 78.03 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.701 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 92.5 mt -64.6 -48.85 73.38 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.965 0.412 . . . . 0.0 110.074 174.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 m0 -58.18 -39.9 80.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.803 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -57.15 -58.82 6.54 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.57 -28.07 36.15 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 115.439 -0.8 . . . . 0.0 113.804 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.7 m -85.15 -69.3 0.66 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 117.395 0.597 . . . . 0.0 111.805 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.5 mp -59.95 -35.09 74.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -172.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -85.67 -2.58 58.33 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -103.85 -26.27 12.75 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 171.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.85 -11.25 59.94 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.308 0.575 . . . . 0.0 109.461 168.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 66.56 78.74 0.25 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.647 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -117.13 170.65 8.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.667 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -125.86 98.22 5.44 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.426 HG12 ' CD2' ' A' ' 109' ' ' LEU . 30.9 m -139.02 153.7 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.756 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.446 ' HB3' ' SD ' ' A' ' 108' ' ' MET . 6.6 tp60 -101.56 145.57 28.85 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 169.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.64 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -148.79 132.84 17.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.618 -169.771 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -129.96 132.88 46.47 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.141 175.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.495 HD11 HG23 ' A' ' 77' ' ' THR . 8.6 tt -91.31 89.03 2.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.704 0.764 . . . . 0.0 109.677 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.4 125.62 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.056 -178.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 101.0 104.6 2.72 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -167.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.446 ' O ' ' HB ' ' A' ' 77' ' ' THR . 16.0 m -47.93 -34.03 8.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.575 0.584 . . . . 0.0 112.575 -175.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.735 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 7.1 p-10 -103.22 -4.19 24.69 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -135.67 136.34 40.85 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.919 0.39 . . . . 0.0 111.789 -164.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.2 154.68 30.71 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.003 175.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.7 tt -123.41 139.05 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.412 178.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -131.41 154.32 48.77 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.114 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 18' ' ' TRP . 0.8 OUTLIER -148.38 135.32 20.07 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.357 0.599 . . . . 0.0 111.821 176.265 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.426 ' CD2' HG12 ' A' ' 95' ' ' VAL . 13.2 mt -108.93 109.33 20.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.589 174.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.72 -27.06 31.42 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 175.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -147.38 111.61 5.18 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.925 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.52 129.32 1.34 Allowed Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.756 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.3 m -95.25 -19.75 19.76 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 111.043 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -75.64 35.9 0.13 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.962 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.0 -56.44 21.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.877 -177.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.426 ' HA ' ' HB3' ' A' ' 119' ' ' LYS . 0.7 OUTLIER -73.96 -14.42 61.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.522 -176.684 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -75.55 -52.47 10.55 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.9 tt -62.38 -39.35 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.723 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 51.9 tttm -54.71 -51.67 64.86 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.511 174.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.49 -43.86 76.0 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.561 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -66.74 -39.76 88.06 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 98.7 mt -65.5 -39.97 92.5 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.046 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 30.0 m -89.41 -2.66 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 120.821 0.343 . . . . 0.0 111.081 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.2 t -61.99 2.16 0.24 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -87.3 104.25 16.23 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.429 0.633 . . . . 0.0 110.347 -174.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -48.31 -44.81 34.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.328 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -69.23 -44.82 71.23 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.449 ' O ' ' HB3' ' A' ' 129' ' ' ALA . 23.5 t -166.75 -152.95 0.14 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.631 -171.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 128' ' ' CYS . . . 84.25 109.23 0.06 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.048 0.939 . . . . 0.0 111.921 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -124.28 141.43 52.07 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.422 175.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 14.8 p -118.83 149.71 21.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.023 0.44 . . . . 0.0 111.474 -174.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.3 m -143.18 146.83 34.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 86.4 mt -86.85 162.32 17.83 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.838 0.352 . . . . 0.0 111.222 -175.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.764 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 1.6 tm-20 . . . . . 0 C--O 1.234 0.286 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.893 177.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 50.6 mm . . . . . 0 CA--C 1.531 0.239 0 CA-C-O 120.792 0.329 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.3 mtm105 -61.15 -50.16 74.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.506 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.98 -49.76 74.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.336 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -58.78 -46.92 86.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.15 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.419 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.2 m-80 -53.19 -71.56 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.173 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -53.6 -61.86 2.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.197 -176.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.405 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.4 -63.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.663 -172.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.58 -43.53 89.46 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.795 -170.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.419 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 35.3 mtp -72.88 -32.5 65.43 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.055 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.32 88.99 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 172.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 94.7 mtt180 -69.23 -18.85 63.93 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.881 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 66.2 tp -79.52 -52.84 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 110.168 175.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 15' ' ' LEU . 3.9 mm? -71.95 -9.37 58.26 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.781 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -48.25 -40.48 24.76 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.64 0.733 . . . . 0.0 109.159 168.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 51.2 tp60 -61.49 -50.06 74.25 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.442 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.433 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 13.8 m95 -59.73 -35.13 73.93 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.485 -177.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -60.95 -46.19 91.71 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -59.08 -44.17 91.88 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.976 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -59.32 -55.09 39.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.718 0.294 . . . . 0.0 110.632 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.2 -37.72 78.13 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.92 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.08 -50.43 73.3 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.59 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.513 HG12 HD13 ' A' ' 29' ' ' LEU . 77.2 mt -58.57 -39.46 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-O 121.134 0.493 . . . . 0.0 110.248 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.7 -35.15 79.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -78.41 -1.21 32.43 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.13 27.46 37.02 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.38 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -126.75 109.94 12.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.617 0.246 . . . . 0.0 110.392 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.513 HD13 HG12 ' A' ' 24' ' ' ILE . 3.5 mm? . . . . . 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.7 tt . . . . . 0 C--O 1.238 0.474 0 CA-C-O 121.841 0.829 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.424 ' HG2' ' HA ' ' A' ' 108' ' ' MET . 67.4 mtp -141.02 144.33 34.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.631 172.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.2 mtt -118.42 122.43 42.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.86 0.362 . . . . 0.0 111.385 -176.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.522 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 52.2 m-85 -98.47 95.38 7.28 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.9 t -87.83 146.43 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 122.244 -0.285 . . . . 0.0 110.327 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.476 ' HB ' ' NH2' ' A' ' 104' ' ' ARG . 7.2 t -125.26 110.37 13.96 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 174.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.527 HG11 HG21 ' A' ' 80' ' ' ILE . 21.4 t -98.44 -60.94 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.355 -169.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -83.34 -50.08 8.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.862 -170.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.8 20.34 74.2 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -168.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -126.35 136.97 29.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 114.743 -0.729 . . . . 0.0 109.125 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -64.05 -15.79 51.26 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.32 2.68 . . . . 0.0 114.693 -172.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.615 HG22 ' HD3' ' A' ' 75' ' ' LYS . 17.1 m -75.76 119.97 20.5 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.555 0.693 . . . . 0.0 111.26 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -55.58 -23.62 28.18 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.528 0.731 . . . . 0.0 111.557 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.615 ' HD3' HG22 ' A' ' 73' ' ' THR . 11.0 mptt -62.2 -62.83 1.49 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.705 -169.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.452 ' OE1' ' HB ' ' A' ' 73' ' ' THR . 13.8 pm0 -65.95 -37.15 85.27 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.543 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.509 HG23 HD11 ' A' ' 99' ' ' ILE . 12.2 t -68.3 -38.79 82.0 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.638 0.256 . . . . 0.0 110.312 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.83 -46.62 89.84 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 45.7 mt-10 -56.18 -54.24 47.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.134 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.608 HD12 HD12 ' A' ' 83' ' ' LEU . 11.1 tp -63.19 -43.14 98.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-O 120.946 0.403 . . . . 0.0 111.006 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.8 m -66.69 -30.7 71.02 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.065 0.46 . . . . 0.0 110.21 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.7 t -70.68 -33.9 71.4 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.699 177.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.608 HD12 HD12 ' A' ' 80' ' ' ILE . 88.0 mt -63.52 -45.16 91.91 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.254 0.549 . . . . 0.0 109.705 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 53.1 m0 -60.85 -44.66 96.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.948 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -57.84 -38.64 76.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.234 0.54 . . . . 0.0 109.982 172.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.18 -31.35 77.28 Favored Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.737 -178.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.4 m -95.99 -60.36 1.65 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.77 -48.05 80.77 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.402 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 64.7 m-85 -69.95 -32.7 71.08 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.739 0.304 . . . . 0.0 110.892 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -67.66 -28.22 67.52 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.237 0.541 . . . . 0.0 109.705 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.85 8.73 11.6 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.366 175.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 68.13 30.17 5.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.094 174.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -89.45 108.36 19.6 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 173.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -80.47 62.74 4.68 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.328 0.585 . . . . 0.0 110.623 178.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.5 m -90.45 167.75 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.113 176.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.749 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.8 tp60 -110.17 143.13 40.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.447 173.129 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.461 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.86 135.13 35.89 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.726 0.298 . . . . 0.0 110.539 -177.831 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -131.02 153.45 49.24 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.509 HD11 HG23 ' A' ' 77' ' ' THR . 9.4 tt -130.71 90.04 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.68 0.752 . . . . 0.0 110.745 -179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.2 p -130.57 128.24 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.9 104.01 2.67 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -167.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -46.68 -25.63 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 67' ' ' THR . 12.1 p-10 -100.67 -27.73 13.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.319 0.58 . . . . 0.0 110.209 178.121 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.476 ' NH2' ' HB ' ' A' ' 67' ' ' THR . 0.2 OUTLIER -84.62 121.57 27.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.764 -171.322 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -116.42 132.42 56.68 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 13.0 tt -124.38 132.25 71.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-O 121.083 0.468 . . . . 0.0 111.44 -173.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -120.74 128.75 53.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.355 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.749 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 1.8 mpt? -99.16 122.33 42.22 Favored 'General case' 0 C--O 1.247 0.971 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.347 177.396 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.454 ' N ' HD22 ' A' ' 109' ' ' LEU . 2.4 mm? -117.64 121.66 41.48 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 123.839 0.712 . . . . 0.0 109.264 174.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.7 mmm-85 -67.89 -49.11 63.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -128.27 110.99 12.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.769 172.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -89.86 47.01 3.15 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.616 -175.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.2 m -59.56 -39.69 84.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.269 0.557 . . . . 0.0 110.481 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 22.0 p90 -98.34 23.32 8.53 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.154 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.54 97.39 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.509 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -67.71 -34.05 76.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.353 -176.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -59.55 -43.58 93.5 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.102 0.477 . . . . 0.0 109.91 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.559 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -65.39 -42.22 93.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.481 176.247 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -53.72 -52.06 61.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.225 0.536 . . . . 0.0 110.182 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.447 ' HA ' HG22 ' A' ' 123' ' ' VAL . 1.7 m-20 -62.04 -38.1 87.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.635 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -61.86 -53.68 52.55 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.722 0.296 . . . . 0.0 110.464 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 76.0 mt -50.65 -47.69 58.49 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.419 177.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.447 HG22 ' HA ' ' A' ' 120' ' ' ASP . 19.8 m -80.22 -13.34 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.583 0.23 . . . . 0.0 111.412 -177.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.1 t -73.9 -0.78 17.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.957 0.408 . . . . 0.0 110.558 175.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.485 HE22 HD11 ' A' ' 80' ' ' ILE . 15.3 mt-30 -84.13 165.24 18.63 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -78.79 -47.1 17.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.776 -167.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -86.89 -20.68 27.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.094 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 57.6 m 67.37 175.36 0.26 Allowed 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.433 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -161.24 156.46 24.18 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.96 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -99.74 157.1 16.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.246 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.69 151.66 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.139 0.495 . . . . 0.0 111.221 -174.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.522 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 59.8 m -124.87 134.49 52.68 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 88.9 mt -96.5 142.75 28.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.329 -175.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.963 178.656 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.2 tt . . . . . 0 CA--C 1.537 0.467 0 CA-C-O 122.246 1.022 . . . . 0.0 108.408 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 18.4 ttp180 -63.06 -37.28 86.57 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.382 -1.281 . . . . 0.0 111.651 -175.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 1.1 m-20 -58.19 -46.62 85.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.19 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.554 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.9 OUTLIER -54.32 -47.67 72.23 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 173.342 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.512 ' O ' ' HB2' ' A' ' 11' ' ' MET . 4.2 m-20 -50.63 -76.18 0.02 OUTLIER 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.735 -177.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -61.3 -61.94 2.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.14 -176.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 5' ' ' ASP . . . -62.44 -50.64 70.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.949 -169.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.554 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 1.3 m-20 -78.48 -43.57 26.74 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.523 -172.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.528 ' O ' HD23 ' A' ' 15' ' ' LEU . 8.9 mmt -63.12 -43.05 99.49 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.833 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 16' ' ' GLU . . . -64.51 -53.91 40.72 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.902 0.382 . . . . 0.0 110.327 177.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.1 ttp-105 -52.33 -38.75 59.42 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.946 -175.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.6 tp -84.88 -49.16 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.334 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 11' ' ' MET . 4.5 mm? -68.11 -21.43 64.95 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -172.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 29.8 mt-10 -55.64 -25.71 40.58 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.914 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 46.4 tt0 -63.08 -49.74 73.31 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 176.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -64.31 -35.29 80.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.161 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.98 -53.19 61.01 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.517 ' O ' HG13 ' A' ' 24' ' ' ILE . 20.1 ttpp -51.67 -43.11 62.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.791 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -62.21 -52.79 62.36 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.546 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -69.55 -28.24 65.83 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.4 -177.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -65.16 -45.78 83.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.1 0.476 . . . . 0.0 110.397 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 20' ' ' LYS . 68.6 mt -60.75 -43.91 96.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.341 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -66.14 -36.25 82.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -63.75 -26.25 68.56 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.413 0.625 . . . . 0.0 109.763 175.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.97 40.84 4.5 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.518 176.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -147.04 110.3 4.82 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 173.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.236 0.363 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.527 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.402 HD22 HD23 ' A' ' 133' ' ' LEU . 2.5 pp . . . . . 0 C--O 1.243 0.753 0 CA-C-O 122.402 1.096 . . . . 0.0 113.553 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 23.8 ptp -125.69 132.61 52.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 113.709 -1.587 . . . . 0.0 107.99 174.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.457 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 82.8 mtp -108.29 116.91 32.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 -174.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.441 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 56.5 m-85 -89.16 125.51 35.08 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.525 HG11 HD22 ' A' ' 122' ' ' LEU . 22.1 t -115.83 98.3 6.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.756 ' HB ' ' HB3' ' A' ' 130' ' ' GLU . 4.9 m -74.41 94.92 2.63 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 176.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 p -102.11 -47.1 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.096 -169.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 m -91.26 -49.23 6.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.883 0.373 . . . . 0.0 111.569 -172.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 66.99 10.96 57.56 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -170.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 33.2 t30 -127.2 125.72 24.11 Favored Pre-proline 0 CA--C 1.533 0.306 0 C-N-CA 123.229 0.612 . . . . 0.0 109.565 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 25.4 Cg_exo -61.94 -18.3 60.48 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.282 2.655 . . . . 0.0 113.503 -177.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.445 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 37.7 m -55.44 104.15 0.12 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.699 0.4 . . . . 0.0 111.073 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.498 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 42.1 mt-10 -50.05 -25.93 3.88 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.579 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 0.3 OUTLIER -58.49 -37.61 75.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.809 -177.113 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -57.74 -64.79 0.78 Allowed 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.639 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.464 ' HA ' HG22 ' A' ' 80' ' ' ILE . 12.6 t -62.3 -36.13 81.17 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.648 -177.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -53.47 -59.7 4.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.988 0.423 . . . . 0.0 110.922 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.78 -45.74 74.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.373 -175.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.464 HG22 ' HA ' ' A' ' 77' ' ' THR . 10.8 tp -66.92 -42.02 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.164 -175.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 67.8 m -69.86 -33.15 71.87 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.638 0.256 . . . . 0.0 110.447 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.6 t -59.33 -47.53 85.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.114 0.483 . . . . 0.0 109.719 175.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.8 mt -59.78 -48.19 82.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.053 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.433 ' CD1' ' HE2' ' A' ' 121' ' ' PHE . 44.1 m0 -58.69 -32.74 69.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.032 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.626 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 29.6 tt0 -66.1 -62.77 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -57.69 -18.12 30.19 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.791 -0.64 . . . . 0.0 114.143 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.3 m -95.88 -65.28 0.98 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 117.498 0.649 . . . . 0.0 111.574 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.33 -52.31 54.76 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.83 0.348 . . . . 0.0 111.34 -173.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.626 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 98.1 m-85 -72.27 -9.13 58.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 0.0 111.156 -176.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 39.2 t30 -72.81 -26.81 61.64 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.51 14.32 17.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.759 177.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 60.11 77.35 0.32 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.037 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -107.33 119.14 38.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.548 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -78.09 69.35 4.29 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.691 0.757 . . . . 0.0 109.768 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.533 HG22 HD13 ' A' ' 109' ' ' LEU . 57.7 t -126.02 136.79 59.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.586 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -101.6 115.46 30.57 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.597 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -107.49 131.93 53.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.243 -175.21 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.529 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.5 m-30 -110.55 131.09 55.35 Favored 'General case' 0 C--O 1.247 0.962 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.4 tt -111.38 89.69 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.991 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.44 144.39 17.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.68 82.51 0.23 Allowed Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.966 -1.254 . . . . 0.0 109.966 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.498 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 12.6 m -50.13 -23.6 2.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -168.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -61.0 -25.07 66.62 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.678 0.275 . . . . 0.0 110.828 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -145.49 159.62 42.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.612 0.72 . . . . 0.0 112.398 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -122.64 139.54 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.857 -1.065 . . . . 0.0 108.326 168.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.529 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 5.1 tt -110.12 126.3 67.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.588 -177.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.464 ' HB3' HG11 ' A' ' 95' ' ' VAL . 96.8 m-85 -112.25 112.1 23.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.185 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.506 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 68.5 mtm -90.93 122.43 33.61 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.533 HD13 HG22 ' A' ' 95' ' ' VAL . 4.0 mm? -87.61 103.92 16.02 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 123.513 0.508 . . . . 0.0 110.718 -175.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.6 -28.95 56.34 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 172.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -135.2 116.27 14.27 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.677 -1.147 . . . . 0.0 108.644 172.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -103.92 16.52 50.56 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.223 -0.513 . . . . 0.0 114.038 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -60.5 -20.39 59.98 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 117.207 0.504 . . . . 0.0 111.373 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -120.0 24.73 10.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.071 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.87 87.65 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.435 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -79.92 -27.01 39.92 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.02 -178.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.15 -50.47 70.3 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.611 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.0 tt -64.68 -41.47 92.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.129 176.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.448 ' HG3' HG11 ' A' ' 131' ' ' VAL . 86.7 tttt -54.83 -53.01 60.78 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.816 0.341 . . . . 0.0 110.943 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.493 ' HA ' HG22 ' A' ' 123' ' ' VAL . 20.0 m-20 -61.08 -39.14 88.79 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.584 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.433 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 89.7 t80 -60.31 -39.96 88.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.924 0.392 . . . . 0.0 109.988 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.2 mt -66.55 -41.01 89.33 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.375 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 120' ' ' ASP . 18.7 m -75.61 -19.08 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.728 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 54.1 m -82.33 0.05 43.46 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.329 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -73.77 162.87 28.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.897 0.38 . . . . 0.0 111.036 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -54.31 -64.4 0.84 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.373 -174.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 127' ' ' ARG . 40.7 mtt180 -65.2 -7.6 13.54 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 44.0 t 57.25 79.24 0.2 Allowed 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -172.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.41 140.77 57.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 -171.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.756 ' HB3' ' HB ' ' A' ' 67' ' ' THR . 39.8 tt0 -79.12 118.39 21.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.727 177.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.448 HG11 ' HG3' ' A' ' 119' ' ' LYS . 48.1 t -101.55 130.14 51.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.47 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 20.7 p -135.86 129.33 32.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.457 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.1 mp -112.43 127.23 55.97 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 . . . . . 0 C--N 1.327 -0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.972 177.364 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.429 HG23 ' ND2' ' A' ' 7' ' ' ASN . 15.3 tt . . . . . 0 CA--C 1.548 0.903 0 CA-C-O 122.268 1.032 . . . . 0.0 108.592 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -71.62 -42.1 68.05 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -163.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -51.74 -50.13 61.2 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.886 0.374 . . . . 0.0 110.981 -172.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.485 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -63.29 -41.32 98.96 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.95 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.645 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 14.4 m-80 -55.7 -72.14 0.08 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.05 -63.06 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.344 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.13 -66.29 0.56 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.648 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -69.5 -43.85 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.928 -169.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.645 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 1.3 mmt -70.68 -45.27 65.35 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.778 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.25 97.49 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.511 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -81.24 -12.84 59.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.531 -177.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.525 ' HG ' HD22 ' A' ' 15' ' ' LEU . 5.5 tp -82.17 -54.33 5.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.026 0.441 . . . . 0.0 110.089 169.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.532 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 4.4 mm? -65.59 -25.55 67.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.92 -177.263 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -51.78 -42.18 62.21 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.325 0.584 . . . . 0.0 109.967 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.55 -48.82 79.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.273 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.506 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 43.6 m95 -58.32 -40.05 81.02 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.877 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 15' ' ' LEU . 41.7 mm-40 -61.36 -49.56 76.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.787 178.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.482 ' O ' HG13 ' A' ' 24' ' ' ILE . 78.9 tttt -60.61 -38.45 84.73 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.937 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -43.1 98.26 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -63.06 -39.82 95.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.303 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -61.43 -45.43 94.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.863 0.364 . . . . 0.0 110.496 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.4 mt -61.35 -36.4 72.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.442 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.1 -45.01 74.92 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -66.9 -17.91 65.13 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.988 176.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.84 48.83 3.29 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.441 173.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -150.29 128.92 12.3 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.422 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.532 0.272 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.157 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.431 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 110.467 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.668 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 15.6 ptm -144.47 112.4 6.3 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.928 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.526 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 65.7 mtt -114.22 122.82 47.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.412 -175.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -93.93 111.14 22.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 171.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 131' ' ' VAL . 30.0 t -112.14 112.29 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 122.241 -0.287 . . . . 0.0 110.96 -172.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.62 HG23 ' HB2' ' A' ' 130' ' ' GLU . 3.8 t -87.56 107.07 18.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.3 m -101.79 -40.04 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.037 -171.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.465 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 36.7 t -86.9 -55.54 3.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.482 -172.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.704 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 78.38 -4.92 57.78 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.525 -171.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -125.87 132.78 24.42 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 123.323 0.649 . . . . 0.0 109.416 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.638 ' O ' ' HB3' ' A' ' 102' ' ' SER . 35.1 Cg_endo -60.13 -16.37 39.45 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.375 2.717 . . . . 0.0 114.389 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.429 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 23.7 m -60.96 100.17 0.11 Allowed 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.933 -0.48 . . . . 0.0 110.116 173.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.43 ' CD ' ' H ' ' A' ' 74' ' ' GLU . 1.3 mp0 -57.11 -23.21 45.43 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.404 -174.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.556 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -55.46 -34.73 64.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.361 -173.315 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.413 ' O ' HD13 ' A' ' 80' ' ' ILE . 34.9 mm-40 -59.26 -50.9 72.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.314 0.578 . . . . 0.0 109.484 176.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.8 m -67.83 -29.73 68.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.815 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.36 -49.86 72.2 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -59.76 -48.37 81.96 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 110.059 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.442 HG13 ' NE2' ' A' ' 125' ' ' GLN . 1.5 mp -53.72 -54.06 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.062 178.4 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.0 m -62.82 -35.45 79.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.076 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.6 t -63.7 -57.34 10.3 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.925 0.393 . . . . 0.0 110.635 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.86 -44.23 97.24 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.811 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.53 ' CZ3' HD22 ' A' ' 122' ' ' LEU . 45.3 m0 -63.89 -38.73 92.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.532 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -59.91 -60.98 2.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.17 -52.17 13.25 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.968 177.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.1 m -59.3 -54.78 42.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.777 0.323 . . . . 0.0 111.686 -176.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 84' ' ' TRP . 9.7 mp -69.28 -29.15 66.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.405 -175.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -75.66 -30.61 59.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.6 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.35 -30.99 70.94 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.71 4.57 36.07 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.384 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.8 t30 60.91 66.19 0.93 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.146 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -115.57 101.29 8.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.57 173.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.74 73.66 1.54 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.501 0.667 . . . . 0.0 110.621 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.2 m -87.98 157.21 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.528 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.506 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.9 tp60 -110.94 100.93 9.55 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.671 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.3 OUTLIER -109.8 138.81 45.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.575 -174.008 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.416 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 68.3 m-85 -134.98 128.52 32.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.26 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.5 tt -87.87 87.57 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-O 121.926 0.87 . . . . 0.0 108.918 169.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 p -132.35 121.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.485 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 100.8 102.74 2.56 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 -163.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.638 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 41.0 m -37.67 -50.6 1.19 Allowed 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -171.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.704 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.5 p-10 -100.62 7.44 43.98 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -173.402 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.5 mtt180 -128.5 139.59 52.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.227 0.537 . . . . 0.0 111.809 -173.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.08 128.16 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.05 171.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.416 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 9.8 tt -98.31 123.14 50.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 121.173 0.511 . . . . 0.0 110.641 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -112.59 108.13 17.1 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.848 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.464 ' SD ' HD11 ' A' ' 15' ' ' LEU . 70.5 mtm -108.34 130.67 55.19 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.093 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 65.8 mt -117.88 122.5 43.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.119 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.452 ' HG3' HH11 ' A' ' 110' ' ' ARG . 0.0 OUTLIER -68.49 -49.86 56.56 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.021 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -113.12 111.67 22.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.977 -1.011 . . . . 0.0 108.706 172.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -108.54 43.86 1.62 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.817 -171.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 m -61.55 -31.6 71.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 110.586 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -101.99 21.31 14.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.014 -176.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.92 -54.94 40.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.581 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -31.56 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.984 -174.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -66.02 -39.55 90.32 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.078 0.466 . . . . 0.0 109.755 177.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.571 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.2 mt -60.76 -52.77 57.68 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.195 173.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.22 -48.39 54.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.94 0.4 . . . . 0.0 110.388 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -59.83 -42.82 94.39 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.995 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.57 -50.16 68.37 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.057 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 13.4 mt -57.68 -43.31 84.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.135 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -74.7 -26.9 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 120.995 -0.282 . . . . 0.0 111.572 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -78.62 2.66 18.63 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.255 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.443 ' HG3' ' HE1' ' A' ' 84' ' ' TRP . 1.1 tm0? -74.13 161.27 30.17 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.776 0.322 . . . . 0.0 111.024 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.74 -66.24 0.58 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.696 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.424 ' N ' ' OE1' ' A' ' 125' ' ' GLN . 36.1 mtm180 -69.99 -3.02 14.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.282 176.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.507 ' SG ' ' N ' ' A' ' 129' ' ' ALA . 42.1 t 73.77 176.58 0.25 Allowed 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.212 0.605 . . . . 0.0 111.48 174.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.507 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -169.8 135.24 1.43 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.711 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.62 ' HB2' HG23 ' A' ' 67' ' ' THR . 39.2 mm-40 -102.23 113.64 27.1 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 173.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.425 HG13 HG22 ' A' ' 66' ' ' VAL . 46.1 t -94.16 120.13 43.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 -177.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.6 m -107.79 130.06 55.0 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.526 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.9 mp -106.37 114.54 28.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.668 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 27.0 mm-40 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.8 tt . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 122.122 0.963 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.549 ' HA ' ' HB2' ' A' ' 7' ' ' ASN . 12.1 mtp180 -70.69 -17.54 62.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.732 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.403 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 13.2 t70 -54.55 -52.34 62.36 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.513 ' OH ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -66.27 -44.51 83.38 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.17 178.667 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.549 ' HB2' ' HA ' ' A' ' 4' ' ' ARG . 25.3 m-80 -51.3 -78.58 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.239 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.96 -59.88 3.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.788 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.583 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -67.86 -60.6 2.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -171.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.616 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 12.8 t70 -69.66 -39.13 77.25 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.974 -169.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.518 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 2.0 mmt -64.42 -45.5 87.31 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.65 -42.58 71.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.871 0.367 . . . . 0.0 110.218 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.616 ' HD2' ' HA ' ' A' ' 10' ' ' ASP . 81.9 mtt180 -54.09 -62.38 1.69 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.083 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.499 HD12 HD22 ' A' ' 15' ' ' LEU . 3.9 pp -80.33 -18.41 49.24 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -171.304 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.499 HD22 HD12 ' A' ' 14' ' ' LEU . 3.5 mm? -79.34 -30.49 42.73 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.132 -0.355 . . . . 0.0 110.945 175.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -50.09 -39.02 41.33 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.265 0.555 . . . . 0.0 110.513 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -61.28 -38.93 88.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.238 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.503 ' CZ2' ' HG2' ' A' ' 108' ' ' MET . 61.7 m95 -66.15 -42.48 88.98 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.211 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -62.59 -46.68 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.557 ' O ' HG13 ' A' ' 24' ' ' ILE . 22.9 tttm -51.58 -54.33 28.81 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.729 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.8 -38.88 76.79 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -173.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -60.0 -45.63 92.13 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.396 0.617 . . . . 0.0 109.377 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 36.9 m-20 -66.54 -28.56 68.64 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.4 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 20' ' ' LYS . 60.1 mt -70.83 -42.85 77.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.255 176.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -73.32 -16.97 61.35 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.047 0.451 . . . . 0.0 109.972 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.454 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.5 tp10 -58.89 -15.15 11.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.443 0.64 . . . . 0.0 109.639 168.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.45 28.14 11.99 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.238 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -160.51 158.88 30.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.1 mm? . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.941 -175.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 62.9 mt . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.588 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 21.8 ptp -138.53 114.34 9.93 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.772 171.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 86.0 mtp -108.88 117.81 35.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.535 -173.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.528 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 1.3 m-85 -97.42 121.31 39.17 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.0 t -117.11 105.51 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.787 0.327 . . . . 0.0 110.492 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 10.1 m -78.29 105.84 9.8 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.765 HG11 HG21 ' A' ' 80' ' ' ILE . 41.3 t -88.97 -61.77 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.482 -170.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.515 ' HB2' ' HG3' ' A' ' 76' ' ' GLU . 47.4 t -92.59 -46.46 7.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.332 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.96 2.97 87.74 Favored Glycine 0 CA--C 1.519 0.287 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -168.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -121.81 132.0 24.32 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 102' ' ' SER . 46.5 Cg_endo -63.43 -15.46 48.58 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.59 2.86 . . . . 0.0 116.058 -165.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.7 133.01 45.35 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.184 0.902 . . . . 0.0 112.437 -169.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -50.33 -42.14 52.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.386 -1.279 . . . . 0.0 113.589 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.882 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.0 mptp? -49.15 -60.84 2.45 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -165.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.515 ' HG3' ' HB2' ' A' ' 69' ' ' SER . 2.1 pm0 -50.81 -60.39 3.11 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.053 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.679 ' HA ' HG22 ' A' ' 80' ' ' ILE . 45.5 m -71.08 -28.36 64.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.841 -174.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.38 -52.24 66.45 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.464 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 43.6 mt-10 -64.97 -48.0 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.243 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.765 HG21 HG11 ' A' ' 68' ' ' VAL . 10.6 tp -62.31 -41.96 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.74 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 96.5 m -67.26 -32.95 74.32 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.862 0.363 . . . . 0.0 110.433 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.2 t -62.47 -40.31 96.22 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.648 HD12 HD12 ' A' ' 80' ' ' ILE . 77.0 mt -62.58 -44.75 95.53 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.434 ' NE1' HG13 ' A' ' 80' ' ' ILE . 49.0 m0 -57.25 -37.36 72.2 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.601 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.455 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 0.7 OUTLIER -62.3 -61.49 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.732 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.51 -19.84 43.03 Favored Glycine 0 CA--C 1.523 0.542 0 CA-C-N 115.683 -0.689 . . . . 0.0 114.266 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.534 ' HB2' HD12 ' A' ' 88' ' ' LEU . 18.1 m -96.38 -69.33 0.76 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.081 0.44 . . . . 0.0 111.193 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.534 HD12 ' HB2' ' A' ' 87' ' ' SER . 4.7 mp -78.51 -57.46 3.76 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.952 0.406 . . . . 0.0 111.259 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.455 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 94.9 m-85 -68.85 -11.34 60.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.251 -173.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -71.98 -27.04 62.5 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.771 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.96 3.67 22.14 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.038 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 62.99 66.33 0.75 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.625 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -84.46 160.71 20.5 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.154 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -95.37 15.88 18.32 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.094 0.473 . . . . 0.0 110.93 -177.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.3 t -88.17 151.55 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.96 176.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -132.39 140.86 48.65 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.05 159.03 42.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.482 -0.192 . . . . 0.0 110.482 -173.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -138.53 154.84 48.78 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.695 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.3 tt -115.5 89.82 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.011 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -118.42 132.73 67.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 173.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 61.3 82.89 0.07 OUTLIER Glycine 0 C--N 1.332 0.34 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 -166.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.42 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 16.9 m -43.69 -42.15 5.17 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -166.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -52.46 -21.7 3.98 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.513 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 33.0 ttt180 -133.12 133.2 42.61 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 110.741 -175.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.88 134.39 52.13 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.2 tt -108.55 132.74 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.72 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -106.09 123.78 48.55 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.425 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.503 ' HG2' ' CZ2' ' A' ' 18' ' ' TRP . 2.1 mpt? -96.11 114.0 25.66 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 171.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.461 ' N ' HD22 ' A' ' 109' ' ' LEU . 2.2 mm? -101.34 103.81 14.78 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.471 -178.197 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.8 mmm-85 -76.24 -50.34 14.71 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 166.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -104.37 110.65 22.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.518 172.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -110.68 11.76 30.15 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.358 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.1 t -58.54 -40.19 82.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.103 0.478 . . . . 0.0 110.423 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -97.85 21.35 10.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.536 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.33 -37.65 88.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.057 0.456 . . . . 0.0 110.404 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -22.76 62.36 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.646 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -73.08 -37.42 66.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.449 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 mt -63.09 -47.82 90.74 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.26 173.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -57.46 -41.84 81.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -58.31 -44.93 88.83 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.343 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' PHE . . . . . 0.412 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 73.1 t80 -64.02 -50.35 68.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.249 177.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 96.4 mt -49.64 -43.91 47.16 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.941 177.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.655 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 28.7 m -84.83 -14.35 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-O 120.971 0.415 . . . . 0.0 111.033 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -80.27 1.1 29.91 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.121 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.42 ' HB2' ' HA ' ' A' ' 128' ' ' CYS . 11.6 mt-30 -71.84 165.09 24.83 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.965 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -54.21 -64.99 0.65 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.635 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -101.05 -15.46 17.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.052 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.655 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 48.8 t 70.88 170.11 0.32 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.068 0.547 . . . . 0.0 111.154 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.453 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -135.91 171.19 14.82 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.734 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.567 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 44.3 mt-10 -84.34 115.04 22.29 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.597 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -87.83 132.9 31.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.528 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 9.2 m -131.51 138.17 48.84 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 35.1 mt -122.2 111.91 17.53 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.588 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 28.3 mm-40 . . . . . 0 C--N 1.328 -0.347 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.4 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.697 HG12 ' HB3' ' A' ' 6' ' ' TYR . 9.5 tt . . . . . 0 N--CA 1.475 0.815 0 CA-C-O 121.48 0.657 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -56.01 -34.2 65.59 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.387 -177.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.53 -48.01 69.44 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.556 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.697 ' HB3' HG12 ' A' ' 3' ' ' ILE . 2.8 t80 -57.55 -47.11 82.94 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.402 ' N ' HD22 ' A' ' 7' ' ' ASN . 0.9 OUTLIER -52.78 -68.11 0.2 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.731 -177.367 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -54.63 -67.65 0.25 Allowed 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.343 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.55 -58.67 7.3 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.728 -171.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -66.4 -56.74 9.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.749 -172.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.631 ' SD ' ' HD2' ' A' ' 65' ' ' PHE . 10.5 mmt -59.63 -49.99 75.63 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.793 0.33 . . . . 0.0 110.663 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.13 -51.8 49.54 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.994 0.426 . . . . 0.0 111.291 -175.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.5 mtt180 -82.47 -6.99 59.64 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.993 -170.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -91.7 -52.54 4.71 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 11' ' ' MET . 4.0 mm? -72.65 -15.59 61.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.289 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -48.4 -41.03 27.81 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.859 0.838 . . . . 0.0 109.51 170.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.4 ' HG3' ' HD2' ' A' ' 20' ' ' LYS . 30.1 tt0 -68.19 -40.23 82.28 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.963 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 3.3 m95 -60.49 -41.44 94.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.86 0.362 . . . . 0.0 110.776 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.69 -47.01 88.17 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.559 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.6 tmtt? -52.3 -44.57 65.1 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.443 177.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.403 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 30.5 m-20 -67.18 -45.96 75.4 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.641 0.257 . . . . 0.0 111.393 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -58.32 -41.53 84.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.826 0.346 . . . . 0.0 110.678 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 22.0 m-20 -67.76 -36.1 79.9 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.782 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.8 mt -58.39 -43.42 86.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 175.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -37.59 87.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 37.5 tt0 -56.55 -22.39 32.99 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.91 174.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.73 31.78 14.7 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.27 -0.49 . . . . 0.0 112.34 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -141.22 129.3 22.05 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--O 1.235 0.335 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.53 -179.971 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 109' ' ' LEU . 2.2 tm? . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.509 0.671 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.655 ' SD ' ' HG3' ' A' ' 108' ' ' MET . 50.5 mtm -133.38 136.35 45.24 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 166.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.461 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 60.4 mtt -118.53 117.65 29.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.196 -174.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.631 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 16.6 m-85 -90.06 101.61 14.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 172.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.6 t -92.56 106.7 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.639 0.257 . . . . 0.0 111.264 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.601 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 87.7 m -83.06 108.28 16.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.65 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 42.7 t -100.97 -60.75 2.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.978 0.418 . . . . 0.0 111.523 -174.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.597 ' HB3' ' HB3' ' A' ' 76' ' ' GLU . 77.7 p -92.9 -60.33 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.3 19.99 79.79 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -164.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.483 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 19.0 t-20 -127.34 133.18 24.79 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 115.19 -0.505 . . . . 0.0 109.822 -176.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 20.5 Cg_exo -65.0 -18.99 63.68 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.249 2.633 . . . . 0.0 114.704 -170.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 40.7 p -61.61 133.42 55.62 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.103 0.478 . . . . 0.0 111.769 -176.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.78 -29.17 70.51 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -177.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.563 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.97 -37.75 61.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.864 -176.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 69' ' ' SER . 5.3 mm-40 -55.04 -68.4 0.19 Allowed 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.821 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.5 t -64.4 -38.38 90.82 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.921 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.56 -61.66 2.34 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.765 0.317 . . . . 0.0 110.575 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.5 mt-10 -60.87 -50.01 75.15 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.247 -175.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.663 HD12 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -64.57 -43.7 96.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.088 -173.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.3 m -64.78 -34.27 77.95 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.635 0.255 . . . . 0.0 110.359 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -62.57 -40.2 96.11 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.663 HD12 HD12 ' A' ' 80' ' ' ILE . 82.3 mt -60.53 -45.75 92.67 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.132 0.491 . . . . 0.0 110.143 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.624 ' HZ3' ' HB3' ' A' ' 105' ' ' ALA . 44.3 m0 -60.79 -57.35 13.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.718 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.533 ' O ' ' HB2' ' A' ' 89' ' ' PHE . 26.0 tt0 -61.51 -23.6 66.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.075 0.464 . . . . 0.0 110.484 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.47 -31.89 58.38 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.026 175.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.2 m -94.23 -63.42 1.19 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.492 HD21 HG13 ' A' ' 118' ' ' ILE . 6.1 mp -62.23 -46.99 86.37 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -173.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.533 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 33.8 m-85 -71.36 -11.32 60.84 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.467 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -70.46 -46.3 64.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 173.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.79 -10.17 59.21 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.977 173.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.7 t30 72.59 48.42 0.22 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.14 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -74.36 100.83 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -73.39 84.38 1.46 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.43 0.633 . . . . 0.0 110.933 -175.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.79 HG12 HD21 ' A' ' 109' ' ' LEU . 4.5 m -111.29 162.01 9.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.115 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.468 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.1 tp60 -101.32 103.79 14.78 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 173.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.597 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -102.04 130.16 48.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.439 -175.834 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -119.63 136.44 54.39 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.6 tt -118.65 107.07 20.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.281 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.48 139.87 10.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.07 103.23 0.13 Allowed Glycine 0 C--O 1.224 -0.488 0 C-N-CA 120.342 -0.933 . . . . 0.0 111.584 -176.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 p -46.85 -35.27 6.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.549 ' HB2' HG21 ' A' ' 3' ' ' ILE . 12.7 t70 -53.23 -38.96 63.41 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.601 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 51.7 mtt180 -138.31 167.43 21.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 122.182 0.991 . . . . 0.0 112.821 -167.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.624 ' HB3' ' HZ3' ' A' ' 84' ' ' TRP . . . -143.88 153.84 42.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.543 162.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.437 HG12 ' SD ' ' A' ' 108' ' ' MET . 12.4 tt -127.0 145.56 34.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -170.198 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -122.34 120.11 33.06 Favored 'General case' 0 CA--C 1.523 -0.063 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.978 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.655 ' HG3' ' SD ' ' A' ' 63' ' ' MET . 4.3 mpp? -103.45 124.09 48.08 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 173.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.79 HD21 HG12 ' A' ' 95' ' ' VAL . 9.1 mt -128.46 141.21 51.47 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.406 0.622 . . . . 0.0 111.479 -177.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.1 mtp-105 -105.91 6.28 31.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.255 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -139.31 138.75 36.97 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -121.57 24.96 7.06 Favored Glycine 0 N--CA 1.453 -0.2 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.474 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.0 m -60.3 -37.75 81.51 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.243 0.544 . . . . 0.0 110.482 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -117.13 24.96 10.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.853 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.07 -47.51 82.63 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.201 0.524 . . . . 0.0 111.061 -178.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -76.72 -20.1 56.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.175 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.14 -48.88 31.76 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.245 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.492 HG13 HD21 ' A' ' 88' ' ' LEU . 8.4 tt -63.5 -41.19 91.81 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.07 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.461 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 63.9 tttm -58.83 -45.27 90.42 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.268 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.3 -40.73 87.11 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.29 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -65.11 -44.2 89.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.1 mt -60.74 -38.63 85.79 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.369 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 31.2 m -87.38 -12.0 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-O 120.853 0.358 . . . . 0.0 111.174 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 17.7 t -86.77 2.05 50.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.383 175.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -60.75 164.31 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.149 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -54.44 -61.64 2.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.32 178.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -80.95 -11.28 59.6 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.55 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 60.0 m 65.77 114.62 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.087 0.555 . . . . 0.0 110.979 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -102.61 144.9 30.42 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.914 -177.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -91.61 127.25 36.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.974 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 43.6 t -106.53 109.86 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.254 -174.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.503 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 31.4 p -92.7 127.12 38.09 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 83.0 mt -87.19 163.17 17.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.926 0.393 . . . . 0.0 111.593 -172.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 62.2 tt0 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 115.333 -0.848 . . . . 0.0 111.412 176.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 121.217 0.532 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -56.64 -38.78 72.6 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.841 -178.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.77 -49.27 77.15 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 177.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -55.72 -43.31 76.41 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.954 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.448 ' OD1' ' HD2' ' A' ' 104' ' ' ARG . 0.9 OUTLIER -58.46 -53.34 59.39 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.151 -177.254 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -52.68 -61.56 2.21 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.84 -61.45 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.509 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.78 -60.0 4.36 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.075 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.441 ' O ' HD23 ' A' ' 15' ' ' LEU . 26.2 mmt -59.4 -52.1 67.08 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.226 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.72 89.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.794 0.33 . . . . 0.0 111.084 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -72.15 -23.94 61.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.748 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.1 tp -80.71 -52.69 7.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.94 0.4 . . . . 0.0 110.625 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -68.08 -20.61 64.96 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.432 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -48.78 -38.28 21.48 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.504 0.668 . . . . 0.0 109.873 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -69.16 -43.68 73.78 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.002 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -59.04 -41.86 88.84 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 120.897 0.38 . . . . 0.0 110.715 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -61.71 -46.28 90.33 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.465 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.5 tmtt? -55.77 -40.88 73.24 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.439 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.438 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 7.4 m-20 -71.03 -44.67 65.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.33 -31.6 72.8 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 121.169 0.509 . . . . 0.0 109.808 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 6.2 m-20 -66.62 -44.98 80.6 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.766 174.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.3 mt -61.26 -34.18 59.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -69.09 -31.33 69.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.004 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.0 tp10 -64.99 -17.85 64.79 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.262 0.553 . . . . 0.0 110.071 170.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.68 29.42 13.6 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.239 -178.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -136.93 126.14 24.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 177.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.446 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.9 mm? . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.629 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.257 0 CA-C-O 121.161 0.505 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 13.5 ptm -145.21 116.06 7.77 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.551 175.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 67.0 mtt -120.23 144.77 47.57 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.55 -174.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' HB3' ' HD3' ' A' ' 104' ' ' ARG . 41.6 m-85 -123.75 100.31 6.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.954 177.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.584 HG21 HD13 ' A' ' 122' ' ' LEU . 16.3 t -91.96 109.73 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -171.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 57.9 m -79.91 104.69 10.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.07 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.429 HG11 HG12 ' A' ' 80' ' ' ILE . 25.5 t -101.86 -58.82 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.049 0.452 . . . . 0.0 111.193 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.721 ' HB2' ' HA ' ' A' ' 103' ' ' ASP . 5.1 m -65.44 -69.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.217 -170.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.21 3.66 89.72 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.45 -0.66 . . . . 0.0 111.45 -171.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 28.4 t-20 -123.13 136.16 26.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 33.6 Cg_exo -60.35 -19.34 57.78 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.284 2.656 . . . . 0.0 114.301 -173.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 m -81.63 140.96 34.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.24 -0.287 . . . . 0.0 110.446 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -72.75 -19.67 61.33 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -171.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -32.16 -61.02 0.26 Allowed 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.616 0.722 . . . . 0.0 112.29 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.41 -51.98 63.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.617 -169.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.581 HG23 HD11 ' A' ' 99' ' ' ILE . 9.6 t -66.04 -33.97 77.01 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.83 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.21 -52.63 57.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.897 0.38 . . . . 0.0 110.126 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.1 -49.4 76.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.104 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.559 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.1 tp -67.52 -42.96 87.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -175.11 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.408 HG21 ' HB ' ' A' ' 99' ' ' ILE . 73.4 m -68.7 -25.13 64.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.685 0.279 . . . . 0.0 110.405 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.8 t -67.31 -48.52 67.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 173.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.486 HD12 HD12 ' A' ' 80' ' ' ILE . 86.1 mt -55.24 -43.7 74.81 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.335 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 53.8 m0 -67.01 -43.83 81.9 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.118 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -55.16 -28.83 55.71 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.365 0.602 . . . . 0.0 109.592 175.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -76.26 -68.2 1.57 Allowed Glycine 0 CA--C 1.518 0.233 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.225 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.7 m -57.54 -54.4 47.24 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.3 mp -64.1 -29.0 70.16 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 111.281 -172.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -101.29 6.24 42.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.475 0.655 . . . . 0.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -89.68 -32.33 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 167.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.56 -14.39 37.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.637 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.0 m120 66.51 80.33 0.22 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.269 176.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -111.58 120.71 43.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.793 171.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.42 83.03 1.95 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.239 0.542 . . . . 0.0 110.254 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.624 HG23 ' HD2' ' A' ' 97' ' ' ARG . 12.5 m -111.07 148.78 14.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.852 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.447 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.5 tp60 -100.79 100.56 11.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.785 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -125.67 141.23 52.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.204 -169.425 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.46 ' O ' HG22 ' A' ' 106' ' ' ILE . 81.5 m-85 -138.72 135.63 34.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.304 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.581 HD11 HG23 ' A' ' 77' ' ' THR . 5.0 tt -87.0 89.76 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.536 0.684 . . . . 0.0 109.445 173.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -135.28 130.71 51.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.307 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 93.83 103.43 1.7 Allowed Glycine 0 C--O 1.225 -0.465 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -171.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -40.9 -34.9 0.45 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.721 ' HA ' ' HB2' ' A' ' 69' ' ' SER . 7.8 p-10 -89.56 -48.4 7.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.521 0.2 . . . . 0.0 111.472 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.529 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 61.6 mtt180 -88.51 155.0 19.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -173.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -128.35 140.72 51.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.379 165.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 98' ' ' PHE . 8.0 tt -109.69 132.09 58.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 111.433 -172.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -123.22 107.69 11.98 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.261 176.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.419 ' SD ' HD11 ' A' ' 15' ' ' LEU . 66.5 mtm -102.1 118.81 37.68 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.52 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 28.6 mt -110.89 131.39 55.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.436 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 29.8 mmm-85 -88.99 4.26 48.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.347 0.594 . . . . 0.0 109.601 173.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -146.13 135.08 22.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.336 176.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -114.11 23.54 12.65 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.99 -176.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.2 t -64.67 -44.87 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -101.61 26.52 7.25 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.005 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -50.38 72.88 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.131 0.491 . . . . 0.0 111.753 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -28.54 62.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 -177.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -69.02 -48.41 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.42 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.587 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.2 tt -63.93 -41.41 92.41 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.497 ' HG2' HG11 ' A' ' 131' ' ' VAL . 14.1 tmtt? -57.56 -49.88 74.92 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 121.05 0.452 . . . . 0.0 110.229 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -56.65 -40.79 76.08 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.553 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -66.14 -47.71 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.918 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 88.8 mt -53.46 -44.77 69.18 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.403 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 28.7 m -81.77 -14.68 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.734 0.302 . . . . 0.0 111.481 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -74.26 1.55 11.17 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.769 0.427 . . . . 0.0 111.633 175.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.559 ' HG2' HD11 ' A' ' 80' ' ' ILE . 0.9 OUTLIER -76.85 164.53 25.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.401 0.619 . . . . 0.0 112.408 -174.269 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -79.76 -45.67 18.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.567 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -66.84 -3.17 6.22 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.726 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 43.6 t 62.51 91.32 0.07 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.222 0.534 . . . . 0.0 110.403 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.16 132.69 45.38 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.537 -177.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -108.27 124.53 50.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.841 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.508 ' HA ' ' HA ' ' A' ' 66' ' ' VAL . 6.5 p -102.84 127.97 56.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.103 0.478 . . . . 0.0 111.735 -173.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.6 m -87.06 121.33 29.37 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.2 tt -105.2 113.45 27.05 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -172.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 C--O 1.235 0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.068 -179.98 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mm . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 120.359 0.123 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -56.41 -50.54 71.33 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.588 0.233 . . . . 0.0 111.609 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.86 -48.97 74.59 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -47.84 73.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.176 176.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.575 ' O ' ' HB2' ' A' ' 11' ' ' MET . 93.4 m-20 -53.12 -76.41 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.947 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.64 -64.07 0.94 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.832 -176.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.548 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -65.59 -61.24 2.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.846 -171.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -74.95 -30.49 61.23 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -168.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.575 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 10.0 mmt -71.42 -37.43 71.48 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.222 175.053 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.92 -48.08 83.15 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.16 173.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 85.7 mtt180 -59.05 -45.31 91.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.188 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.509 HD21 ' HD2' ' A' ' 98' ' ' PHE . 61.3 tp -71.1 -53.2 15.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.853 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.465 HD23 ' O ' ' A' ' 11' ' ' MET . 4.1 mm? -69.12 -18.59 63.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.129 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -48.74 -49.95 35.91 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.021 0.439 . . . . 0.0 110.799 175.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.452 ' HG3' ' N ' ' A' ' 18' ' ' TRP . 7.1 pt20 -66.71 -35.22 79.61 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.548 -177.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.466 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 76.8 m95 -67.03 -42.24 85.2 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.088 0.471 . . . . 0.0 110.428 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.07 -48.89 79.94 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.581 ' O ' HG13 ' A' ' 24' ' ' ILE . 88.2 tttt -57.59 -45.75 84.9 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.668 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -58.13 -54.16 50.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.984 0.421 . . . . 0.0 110.846 -177.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.54 -39.36 79.98 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.669 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 4.0 m-20 -72.56 -30.73 64.68 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.514 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 20' ' ' LYS . 67.9 mt -65.11 -37.75 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.91 -26.7 60.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.547 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 4.9 mm-40 -62.14 -17.32 57.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.233 166.066 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.46 9.76 62.75 Favored Glycine 0 N--CA 1.453 -0.203 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.824 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.91 124.96 47.3 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 C--N 1.327 -0.379 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' HG ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.425 0 CA-C-O 121.901 0.858 . . . . 0.0 113.254 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.609 ' HE3' ' HG3' ' A' ' 134' ' ' GLU . 72.9 mtm -142.32 133.66 26.36 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.307 168.073 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.53 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 63.0 mtt -114.64 129.15 56.64 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -172.394 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.518 ' HE1' ' HA ' ' A' ' 134' ' ' GLU . 43.5 m-85 -91.1 116.46 28.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 168.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -112.96 108.2 24.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.665 0.269 . . . . 0.0 110.965 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 37.8 m -77.15 106.52 8.92 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.418 HG21 HG23 ' A' ' 77' ' ' THR . 97.9 t -85.24 -61.05 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.081 0.467 . . . . 0.0 111.682 -172.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.5 t -91.65 -41.61 10.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.931 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.56 -10.18 65.41 Favored Glycine 0 C--N 1.33 0.243 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -167.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.407 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 25.7 t-20 -126.23 130.82 23.85 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 123.865 0.866 . . . . 0.0 109.004 178.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 80.0 Cg_exo -46.3 -16.61 0.25 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.185 3.257 . . . . 0.0 116.263 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.9 p -60.18 97.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.682 0.674 . . . . 0.0 112.347 -172.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.413 ' CA ' ' HB3' ' A' ' 102' ' ' SER . 40.0 tt0 -43.34 -30.92 0.57 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.132 -0.94 . . . . 0.0 112.415 176.033 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -35.04 -66.9 0.16 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 123.998 0.811 . . . . 0.0 111.935 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -62.93 -43.75 97.94 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.975 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.418 HG23 HG21 ' A' ' 68' ' ' VAL . 38.6 m -63.93 -39.8 94.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.282 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.54 -50.01 60.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.384 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.84 -54.16 45.97 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 120.985 0.422 . . . . 0.0 110.929 177.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.635 HD12 HD12 ' A' ' 83' ' ' LEU . 10.2 tp -67.07 -40.0 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.324 -174.066 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.461 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 70.5 m -61.48 -37.34 83.26 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.673 0.273 . . . . 0.0 110.394 176.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.401 ' HA ' HE21 ' A' ' 85' ' ' GLN . 50.9 m -61.02 -44.84 96.82 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 80' ' ' ILE . 78.3 mt -58.53 -47.48 84.04 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 176.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.416 ' CE2' HG13 ' A' ' 80' ' ' ILE . 48.9 m0 -58.7 -45.87 88.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.093 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.6 mt-30 -58.51 -60.03 4.44 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.44 -40.06 10.73 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.342 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 m -73.17 -58.02 3.61 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 111.373 -178.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.3 mt -57.99 -54.14 50.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -174.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -65.94 -31.13 71.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.38 -174.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.66 -24.07 59.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.282 0.563 . . . . 0.0 109.723 176.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.13 14.4 12.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.43 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.5 t30 73.26 9.46 5.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.703 175.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -81.28 91.92 6.29 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.038 -0.413 . . . . 0.0 109.968 176.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.77 94.46 7.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.08 165.25 16.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.316 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.499 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.1 tp60 -104.53 152.97 21.74 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 177.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.538 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -155.65 126.82 7.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.78 0.324 . . . . 0.0 110.36 -177.465 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.509 ' HD2' HD21 ' A' ' 14' ' ' LEU . 15.8 m-30 -113.82 124.15 51.53 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 tt -102.32 88.77 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 122.136 0.97 . . . . 0.0 109.734 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.39 141.98 45.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.111 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 67.19 76.27 0.39 Allowed Glycine 0 C--O 1.224 -0.489 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -169.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.413 ' HB3' ' CA ' ' A' ' 74' ' ' GLU . 24.6 m -35.21 -34.6 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -165.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.76 -34.17 72.63 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.176 0.513 . . . . 0.0 111.849 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 88.3 mtt180 -128.09 134.69 49.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.162 0.506 . . . . 0.0 111.93 -171.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.64 128.56 54.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.539 -0.755 . . . . 0.0 108.975 173.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.6 tt -104.46 133.14 49.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 110.704 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -116.11 129.62 56.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.07 -177.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.573 ' HA ' ' HG2' ' A' ' 63' ' ' MET . 2.0 mpt? -108.87 122.71 47.77 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.679 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' A' ' 62' ' ' LEU . 0.8 OUTLIER -128.01 114.75 17.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 172.1 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -61.79 -34.32 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -170.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -118.38 111.49 18.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.101 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.54 48.46 3.9 Favored Glycine 0 C--N 1.332 0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.166 -174.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.4 t -68.39 -71.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.981 0.419 . . . . 0.0 110.003 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.1 p90 -80.54 30.17 0.3 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.631 177.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.82 -41.53 82.42 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.234 0.54 . . . . 0.0 111.445 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' TRP . . . . . 0.413 ' HA ' ' HE3' ' A' ' 119' ' ' LYS . 21.0 m95 -75.11 -32.89 61.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.009 -174.164 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.83 -53.57 44.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.153 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.592 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.2 tt -61.62 -38.36 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.079 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.53 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 24.5 ttpp -53.51 -55.55 24.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.144 0.497 . . . . 0.0 110.788 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.668 ' HA ' HG22 ' A' ' 123' ' ' VAL . 3.3 m-20 -64.22 -30.99 72.02 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.846 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -64.93 -36.51 84.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.959 0.409 . . . . 0.0 110.034 176.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 81.3 mt -67.43 -46.26 73.67 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.278 178.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.668 HG22 ' HA ' ' A' ' 120' ' ' ASP . 12.5 m -82.21 -4.51 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.582 -177.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.4 t -70.04 1.24 4.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.92 0.488 . . . . 0.0 111.765 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -83.19 143.11 30.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.007 0.432 . . . . 0.0 111.529 -174.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -43.89 -62.35 1.15 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.063 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 48.9 ttt180 -80.78 21.24 0.69 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 56.6 m 70.99 -166.94 0.15 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.701 0.4 . . . . 0.0 111.779 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 171.71 119.41 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.603 -176.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 34.8 mt-10 -87.17 144.14 26.98 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.2 p -138.72 139.72 40.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.926 0.393 . . . . 0.0 111.302 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 18.2 p -138.33 140.47 39.51 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 176.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 61.3 mt -88.4 154.31 20.48 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.639 0.257 . . . . 0.0 111.172 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.609 ' HG3' ' HE3' ' A' ' 63' ' ' MET . 1.7 tm-20 . . . . . 0 C--N 1.331 -0.218 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 176.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.778 HG12 ' HB3' ' A' ' 6' ' ' TYR . 15.0 tt . . . . . 0 CA--C 1.545 0.76 0 CA-C-O 122.316 1.055 . . . . 0.0 109.039 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -55.41 -43.41 75.25 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 114.495 -1.23 . . . . 0.0 112.274 -169.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.98 -46.13 71.59 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.082 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.778 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -58.57 -47.15 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.989 176.656 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.571 ' O ' ' HB2' ' A' ' 11' ' ' MET . 90.6 m-20 -55.15 -71.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.405 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -51.23 -69.47 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.093 -178.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.17 -58.75 7.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.746 -171.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.96 -45.97 55.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.915 -168.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.571 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 17.2 mmt -69.01 -43.27 75.14 Favored 'General case' 0 N--CA 1.461 0.125 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.707 -176.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.47 -49.94 67.19 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.835 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -67.95 -27.81 66.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.653 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -78.78 -52.09 8.86 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.891 0.377 . . . . 0.0 111.2 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -72.55 -25.13 61.25 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -173.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -59.75 -29.45 68.17 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -55.8 -58.11 9.21 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.854 174.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.1 m95 -58.94 -30.15 67.67 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.667 -178.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.82 -62.89 1.53 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.379 175.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.478 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.1 ttmt -57.37 -47.14 82.42 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.152 -178.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.42 -46.49 73.21 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 123.377 0.423 . . . . 0.0 110.632 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 28.6 t70 -61.64 -41.9 98.14 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.141 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -66.89 -24.87 66.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.08 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 20' ' ' LYS . 70.5 mt -71.28 -37.5 66.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 174.08 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -68.34 -31.55 71.02 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.571 173.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 22' ' ' ASP . 14.9 mm-40 -69.21 -35.38 76.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.349 0.595 . . . . 0.0 109.645 172.372 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.64 48.02 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.726 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -116.88 94.2 4.5 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.434 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.533 0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.027 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--O 1.235 0.296 0 CA-C-O 121.062 0.458 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.677 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 17.1 ptm -140.87 111.74 7.07 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.867 176.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.5 mtt -113.47 130.21 56.38 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.385 -174.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -100.05 118.86 37.31 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.442 HG22 HG13 ' A' ' 131' ' ' VAL . 35.4 t -113.94 101.7 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 -175.484 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.645 HG23 ' HB2' ' A' ' 130' ' ' GLU . 5.1 t -83.19 106.2 14.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 109.459 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.438 HG11 HG12 ' A' ' 80' ' ' ILE . 17.3 t -101.29 -60.78 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.831 -173.062 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.3 t -72.57 -59.7 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.685 -176.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.508 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 75.62 0.92 64.57 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.523 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.459 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 22.9 t-20 -126.26 132.29 24.26 Favored Pre-proline 0 CA--C 1.535 0.367 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 32.6 Cg_exo -58.71 -17.91 38.2 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.628 2.886 . . . . 0.0 114.513 -171.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.1 p -57.9 107.16 0.43 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 111.912 -178.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -47.61 -31.27 4.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.04 0.936 . . . . 0.0 112.641 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.618 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 11.9 mptt -49.29 -50.88 37.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.135 0.493 . . . . 0.0 111.081 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.3 -50.33 74.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.452 -174.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.456 HG23 HD11 ' A' ' 99' ' ' ILE . 14.6 t -67.83 -39.47 83.88 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.793 -175.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.06 -53.3 59.91 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -54.95 -63.13 1.25 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.135 179.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.438 HG12 HG11 ' A' ' 68' ' ' VAL . 11.4 tp -63.41 -46.35 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.599 -171.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.4 HG21 ' HB ' ' A' ' 99' ' ' ILE . 55.3 m -67.99 -31.72 71.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.488 -0.132 . . . . 0.0 111.159 -177.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.1 t -67.73 -44.45 77.57 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 177.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 99.3 mt -60.69 -40.94 94.05 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.508 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 40.1 m0 -62.98 -47.79 81.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.664 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -55.73 -57.84 10.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.027 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -43.93 -58.34 4.33 Favored Glycine 0 C--N 1.333 0.395 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.991 173.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -49.53 75.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.59 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 95.3 mt -60.71 -56.57 19.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.083 -177.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -68.34 -20.3 64.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.07 -177.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -68.73 -38.0 79.85 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.164 0.507 . . . . 0.0 110.197 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.8 5.72 50.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.224 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 64.64 65.12 0.64 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.596 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.59 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 17.4 m-85 -102.1 88.16 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 168.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -77.21 72.57 3.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 109.785 -177.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.856 HG12 HD21 ' A' ' 109' ' ' LEU . 4.5 m -104.62 161.02 4.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.015 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.467 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.4 tp60 -102.0 105.42 16.18 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.744 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -119.96 145.35 46.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.972 -174.448 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.474 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 81.8 m-85 -130.97 127.01 37.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.068 0.461 . . . . 0.0 109.951 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.456 HD11 HG23 ' A' ' 77' ' ' THR . 7.5 tt -99.26 90.51 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.935 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -136.86 128.71 43.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.584 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.26 97.99 0.15 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 -172.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.9 m -45.19 -32.58 1.93 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -172.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.508 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 2.5 m-20 -57.47 -51.92 67.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.471 177.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.438 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 69.9 mtt180 -120.92 134.37 55.3 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -171.244 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.91 127.96 55.06 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 168.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.474 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 6.1 tt -98.71 132.94 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.989 0.423 . . . . 0.0 111.257 -177.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -124.22 123.8 41.05 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.593 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 76.6 mtm -128.12 146.81 50.59 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.267 0.556 . . . . 0.0 111.41 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.856 HD21 HG12 ' A' ' 95' ' ' VAL . 22.4 mt -133.28 137.64 46.1 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.436 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.37 -55.42 4.17 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 172.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -128.3 111.51 13.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.466 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.91 95.91 0.12 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.308 -176.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.5 t -70.66 -23.39 62.5 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 109.872 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.29 14.36 1.23 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.914 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.74 75.38 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.051 0.453 . . . . 0.0 111.529 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 16.8 m95 -79.49 -23.86 42.7 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.185 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -72.67 -48.45 39.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.881 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.1 tt -64.17 -41.29 91.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.6 -41.45 81.26 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.8 -40.8 94.04 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.153 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -60.66 -40.44 92.04 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.435 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 47.7 mt -65.96 -40.55 91.39 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.256 -178.215 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 24.6 m -81.07 -22.91 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 120.809 0.338 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.5 m -87.17 2.7 49.11 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.127 0.489 . . . . 0.0 110.583 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.508 ' NE2' ' NE1' ' A' ' 84' ' ' TRP . 6.6 tp-100 -66.74 156.47 35.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.621 -174.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -45.16 -67.74 0.26 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.001 0.52 . . . . 0.0 111.879 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -69.77 -17.84 63.45 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.604 177.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 42.3 t 68.8 116.59 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.609 0.568 . . . . 0.0 109.919 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.59 143.28 32.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.934 -175.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.645 ' HB2' HG23 ' A' ' 67' ' ' THR . 38.9 mt-10 -91.66 113.39 25.64 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.01 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.442 HG13 HG22 ' A' ' 66' ' ' VAL . 37.5 t -104.25 138.73 27.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -178.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.5 p -125.54 136.34 53.22 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 62.4 mt -94.13 110.89 22.58 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.677 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 53.8 mm-40 . . . . . 0 C--N 1.325 -0.461 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt . . . . . 0 CA--C 1.536 0.434 0 CA-C-O 121.969 0.89 . . . . 0.0 108.796 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.5 ttm105 -51.95 -31.79 30.41 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.524 -176.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -54.73 -45.6 74.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.627 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.0 -44.04 98.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 178.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.566 ' O ' ' HB2' ' A' ' 11' ' ' MET . 1.1 m-80 -53.77 -70.39 0.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.45 -62.68 1.5 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.935 -175.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.49 -64.27 1.0 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.758 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -68.0 -39.44 83.23 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.672 -169.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 24.2 mmt -70.52 -45.99 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.979 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -59.65 -43.64 93.81 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.052 0.454 . . . . 0.0 110.484 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -72.54 -31.68 65.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.469 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.9 tp -71.59 -52.77 16.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.962 0.411 . . . . 0.0 110.29 177.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.76 -17.02 61.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.174 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 16.5 tp10 -51.07 -49.75 60.04 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 121.268 0.556 . . . . 0.0 110.206 173.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 21' ' ' ASP . 18.2 tt0 -64.93 -43.01 94.14 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 m95 -55.09 -41.88 72.16 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.612 0.57 . . . . 0.0 110.833 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.28 -52.32 66.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.649 ' HE2' HD11 ' A' ' 24' ' ' ILE . 88.2 tttt -62.22 -27.68 69.15 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.946 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 17' ' ' GLN . 35.6 m-20 -67.83 -49.39 62.47 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -72.27 -25.84 61.76 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.052 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -61.97 -54.6 39.45 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.285 0.564 . . . . 0.0 110.391 171.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.649 HD11 ' HE2' ' A' ' 20' ' ' LYS . 77.8 mt -59.17 -35.87 59.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.995 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.97 -42.64 99.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.195 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -78.2 3.29 15.62 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.034 0.445 . . . . 0.0 110.93 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.22 53.12 3.21 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 116.236 -0.438 . . . . 0.0 113.95 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -158.64 136.2 10.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.034 0.417 . . . . 0.0 111.171 175.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.578 HD13 HG12 ' A' ' 24' ' ' ILE . 2.5 mm? . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.074 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.416 HD13 ' HB1' ' A' ' 115' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 121.719 0.771 . . . . 0.0 112.738 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.453 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 18.0 ptp -136.47 127.27 27.37 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.739 -1.118 . . . . 0.0 108.786 172.024 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.7 mtt -110.35 125.32 53.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 0.0 111.344 -173.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.504 ' HE2' ' SD ' ' A' ' 11' ' ' MET . 49.8 m-85 -102.91 105.01 15.29 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.644 HG21 HD13 ' A' ' 122' ' ' LEU . 21.7 t -98.11 105.41 17.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.245 -171.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.8 m -79.02 103.5 9.01 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.63 HG11 HG12 ' A' ' 80' ' ' ILE . 26.0 t -96.18 -62.71 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.811 0.338 . . . . 0.0 111.739 -171.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.6 t -92.56 -64.3 1.12 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.426 -173.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 89.78 -9.25 77.86 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 -172.047 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -92.72 125.49 55.33 Favored Pre-proline 0 CA--C 1.532 0.273 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.38 -19.8 68.38 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.172 2.581 . . . . 0.0 114.21 -170.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.448 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.5 m -66.04 113.93 4.83 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 52.3 mt-10 -60.45 -24.65 65.39 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -168.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.534 ' HD3' ' N ' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -49.96 -31.23 12.07 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.894 0.378 . . . . 0.0 111.593 -178.911 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.534 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 31.6 mm-40 -60.37 -60.09 4.37 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.083 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.647 ' HB ' ' HA ' ' A' ' 102' ' ' SER . 15.1 t -62.82 -33.43 75.21 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.511 -178.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -54.94 -59.29 4.94 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.08 176.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -57.47 -54.54 45.71 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.149 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.657 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.6 tp -63.91 -44.95 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.779 -171.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.436 HG21 ' HB ' ' A' ' 99' ' ' ILE . 39.5 m -67.03 -34.29 77.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.543 0.211 . . . . 0.0 110.61 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.2 t -63.62 -45.09 91.83 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.896 0.379 . . . . 0.0 110.201 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.6 mt -62.64 -44.73 95.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.553 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.402 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 20.8 m0 -65.37 -43.78 89.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.859 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -60.2 -29.71 68.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.313 0.578 . . . . 0.0 110.091 172.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -77.9 -26.12 61.02 Favored Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 112.307 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.0 m -96.11 -56.26 2.7 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.96 -49.26 76.25 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.702 0.287 . . . . 0.0 111.597 -175.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -71.05 -21.62 62.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.769 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.25 -35.09 66.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.232 0.539 . . . . 0.0 109.762 174.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.65 7.32 34.09 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.481 176.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.3 t30 65.82 70.39 0.44 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.463 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -130.3 95.77 3.99 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.293 171.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -84.16 70.87 10.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.615 0.721 . . . . 0.0 109.669 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 31.8 m -95.77 169.48 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.07 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.42 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -101.48 104.7 15.64 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.877 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.59 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.4 OUTLIER -111.51 138.49 47.97 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.25 -178.376 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.451 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.4 m-85 -130.0 150.85 51.1 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 175.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.436 ' HB ' HG21 ' A' ' 81' ' ' THR . 6.9 tt -130.75 96.81 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.399 -171.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -149.01 133.38 9.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 80.59 102.72 0.3 Allowed Glycine 0 C--O 1.227 -0.314 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.083 -173.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.647 ' HA ' ' HB ' ' A' ' 77' ' ' THR . 18.9 t -53.85 -28.27 34.85 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.913 0.387 . . . . 0.0 111.924 -174.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.584 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 10.0 p-10 -61.42 -36.84 81.45 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -134.39 141.2 46.77 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.54 137.75 53.01 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 167.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.451 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 10.2 tt -111.81 128.24 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.15 0.5 . . . . 0.0 111.633 -172.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -121.18 117.96 28.45 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.615 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.2 mtm -115.76 133.47 56.0 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.716 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 109' ' ' LEU . 4.2 mp -132.51 155.44 48.59 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.751 -176.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 110' ' ' ARG . 44.7 mtm105 -105.86 6.01 31.19 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 167.272 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -100.59 149.54 23.63 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.883 -177.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -131.36 19.16 4.87 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 175.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.9 t -93.98 -60.37 1.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.725 0.298 . . . . 0.0 110.222 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -99.07 8.26 45.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.937 0.398 . . . . 0.0 110.568 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.416 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -54.79 -38.03 66.79 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.21 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -76.11 -35.42 59.31 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.217 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -58.94 -52.5 65.48 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.406 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.6 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 4.3 tt -60.08 -42.53 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.34 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.471 ' HB3' ' HZ2' ' A' ' 119' ' ' LYS . 4.2 ttpm? -52.51 -54.88 26.62 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.344 0.592 . . . . 0.0 110.912 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.61 ' HA ' HG22 ' A' ' 123' ' ' VAL . 2.6 m-20 -65.17 -31.02 72.0 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.875 -177.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -64.48 -45.1 88.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.644 HD13 HG21 ' A' ' 66' ' ' VAL . 74.5 mt -58.36 -45.19 88.67 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.852 177.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.61 HG22 ' HA ' ' A' ' 120' ' ' ASP . 14.3 m -77.5 -17.51 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.758 0.313 . . . . 0.0 111.539 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -81.1 2.38 27.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 178.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.657 ' HG2' HD11 ' A' ' 80' ' ' ILE . 6.3 tp-100 -68.01 163.32 22.53 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.092 -174.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -66.08 -46.21 78.52 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.208 0.527 . . . . 0.0 109.752 -176.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -70.29 -20.94 63.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.432 174.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.4 m 66.11 167.33 0.21 Allowed 'General case' 0 CA--C 1.534 0.332 0 O-C-N 123.716 0.635 . . . . 0.0 109.296 -167.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.48 146.56 6.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.844 0.354 . . . . 0.0 111.322 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -94.53 112.78 24.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.553 176.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -96.55 112.34 28.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.218 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 65.3 p -95.43 132.16 40.8 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 67.7 mt -99.26 117.51 33.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -175.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.453 ' HB3' ' HG3' ' A' ' 63' ' ' MET . 10.8 tp10 . . . . . 0 C--O 1.237 0.412 0 CA-C-O 120.855 0.359 . . . . 0.0 110.54 -177.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.654 HG21 ' HB2' ' A' ' 103' ' ' ASP . 16.0 tt . . . . . 0 CA--C 1.54 0.575 0 CA-C-O 121.866 0.841 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.484 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 59.4 ttt-85 -59.55 -29.38 67.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.514 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -57.53 -46.5 83.77 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.457 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.1 OUTLIER -56.15 -44.33 79.17 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.702 173.223 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -53.45 -76.38 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -179.059 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.5 -59.83 4.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.485 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.571 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.94 -57.16 10.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.905 -171.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -69.58 -45.06 69.54 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.771 -171.016 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.421 ' SD ' ' HD2' ' A' ' 65' ' ' PHE . 25.4 mmt -63.72 -37.59 87.91 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.1 -50.58 72.68 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.848 0.356 . . . . 0.0 110.394 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 66.8 mtm180 -57.63 -45.5 85.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.268 -176.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -75.48 -52.23 11.17 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.537 -176.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.408 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -75.53 -15.95 60.33 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -172.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.62 -35.15 65.57 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.14 -42.04 99.41 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.485 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -61.44 -41.82 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.743 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.98 -42.74 94.28 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.503 ' O ' HG13 ' A' ' 24' ' ' ILE . 3.1 tttm -52.99 -52.09 59.47 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.048 176.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.432 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 13.5 m-20 -69.45 -35.63 75.84 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.442 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -56.9 -48.93 77.05 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -62.39 -44.81 95.57 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.12 177.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 20' ' ' LYS . 64.5 mt -59.03 -42.21 85.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.723 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.88 -13.2 59.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.538 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.65 -11.75 61.09 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.48 0.657 . . . . 0.0 109.312 166.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.24 28.1 11.18 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 114.288 171.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -154.07 152.5 30.54 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 169.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.6 mm? . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.43 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 HD13 ' A' ' 109' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.164 0.506 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.408 ' SD ' HD12 ' A' ' 15' ' ' LEU . 45.7 mtm -134.13 136.96 44.2 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 170.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.648 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 61.2 mtt -120.26 118.22 29.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.45 . . . . 0.0 111.185 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 13.1 m-85 -92.41 102.9 15.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 172.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.517 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 18.6 t -94.22 105.03 16.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.156 -170.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 47.7 m -77.25 101.4 6.22 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.015 178.069 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.475 HG11 HG21 ' A' ' 80' ' ' ILE . 42.8 t -101.43 -60.67 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.755 -177.342 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 t -81.75 -68.07 0.73 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.845 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.661 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 81.88 -10.71 51.15 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -169.177 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -109.25 133.73 20.69 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -64.5 -17.37 59.39 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.98 2.453 . . . . 0.0 114.702 -169.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.0 p -60.36 112.0 1.78 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.338 0.517 . . . . 0.0 111.221 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.419 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 10.4 pt-20 -57.98 -15.59 9.49 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.872 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -47.16 -54.18 11.25 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.075 175.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -58.5 -55.73 31.22 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.276 -0.874 . . . . 0.0 110.884 -172.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.495 ' HA ' HG22 ' A' ' 80' ' ' ILE . 10.6 t -63.73 -31.87 73.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.592 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.49 -52.95 62.38 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.208 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -58.03 -54.78 43.08 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.046 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.609 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.8 tp -65.32 -42.83 94.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.318 -173.234 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 86.2 m -68.38 -28.07 66.78 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.675 0.274 . . . . 0.0 110.436 178.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 48.3 t -62.85 -48.76 77.64 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 73.9 mt -58.67 -52.36 66.03 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.098 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.8 m0 -63.13 -29.97 71.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.406 -177.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.26 -60.19 3.73 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.42 -33.11 16.13 Favored Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.25 -0.887 . . . . 0.0 113.671 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.0 m -84.05 -67.89 0.76 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.77 -56.55 13.19 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 112.112 -172.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -76.53 -15.16 59.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.641 -170.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -80.32 -23.87 40.33 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.65 10.6 22.56 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.719 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.0 m120 70.63 24.89 4.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.826 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -71.54 100.07 2.18 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 173.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -85.36 69.86 10.75 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.495 0.664 . . . . 0.0 110.366 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.4 HG12 ' HG ' ' A' ' 109' ' ' LEU . 24.4 m -107.47 159.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.024 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.406 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -100.53 136.93 39.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.587 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -140.58 135.55 31.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.088 -169.304 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.415 ' O ' HG22 ' A' ' 106' ' ' ILE . 28.4 m-85 -130.46 132.37 45.65 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.587 174.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.483 HD11 HG23 ' A' ' 77' ' ' THR . 6.9 tt -109.69 89.75 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 109.9 179.084 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -138.24 131.77 41.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.85 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.03 98.47 0.11 Allowed Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 -172.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.419 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 15.0 m -49.29 -27.76 4.14 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.984 0.514 . . . . 0.0 112.315 -174.243 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.661 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 35.7 t70 -47.33 -47.37 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.561 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.517 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 51.0 mtt180 -135.98 147.09 47.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.557 0.694 . . . . 0.0 112.616 -172.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -112.32 122.5 47.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 166.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.712 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.7 tt -98.49 133.63 40.14 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.74 -173.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -126.89 109.63 12.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.504 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.712 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.5 mpp? -96.8 124.57 40.82 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 178.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.422 HD13 HD12 ' A' ' 62' ' ' LEU . 6.0 mp -111.72 102.98 11.24 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.55 -32.88 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 176.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -141.63 126.89 18.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.173 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 167.11 118.4 0.44 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.521 -0.847 . . . . 0.0 113.161 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.5 m -81.25 -18.86 44.52 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -79.57 33.7 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.11 -175.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.421 ' O ' HG22 ' A' ' 118' ' ' ILE . . . -61.95 -59.5 5.02 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.135 0.493 . . . . 0.0 111.857 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -26.94 64.06 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.884 0.373 . . . . 0.0 110.241 -176.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.52 -52.5 52.17 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.368 177.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.584 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 tt -62.57 -39.58 85.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.5 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 84.3 tttt -58.16 -43.16 87.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.12 176.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.565 ' HA ' HG22 ' A' ' 123' ' ' VAL . 27.0 t70 -63.56 -37.48 87.47 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.233 0.539 . . . . 0.0 110.181 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -66.14 -33.06 74.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.829 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.0 mt -68.72 -47.73 65.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.355 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.565 HG22 ' HA ' ' A' ' 120' ' ' ASP . 18.9 m -73.58 -8.67 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.2 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -65.32 -0.12 1.68 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.954 171.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.609 ' HG2' HD11 ' A' ' 80' ' ' ILE . 1.8 mp0 -101.59 85.94 2.85 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -178.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -55.71 -28.96 58.49 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.492 -175.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.513 ' O ' ' SG ' ' A' ' 128' ' ' CYS . 71.3 mtt85 -61.7 -46.25 90.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.18 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 127' ' ' ARG . 97.7 m -168.2 123.47 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -177.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.499 ' HB1' ' HA ' ' A' ' 123' ' ' VAL . . . -164.22 93.64 0.7 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.053 0.454 . . . . 0.0 111.526 -177.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.476 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 40.5 mt-10 -127.04 150.01 49.65 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 172.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.2 p -155.43 142.24 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.855 0.36 . . . . 0.0 111.348 -176.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 41.5 p -126.71 138.19 53.36 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.648 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 6.0 mp -97.68 172.24 7.83 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.569 -0.16 . . . . 0.0 110.569 -175.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -177.986 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 3' ' ' ILE . 13.6 tt . . . . . 0 CA--C 1.537 0.456 0 CA-C-O 121.547 0.689 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.516 ' HA ' HD22 ' A' ' 7' ' ' ASN . 49.6 ttt180 -56.02 -35.22 66.61 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.418 -177.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.23 -43.88 61.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.299 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.452 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -62.36 -42.21 99.22 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.883 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.531 ' O ' ' HB2' ' A' ' 11' ' ' MET . 49.0 m-80 -58.87 -66.4 0.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.865 -177.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -51.79 -60.82 2.73 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.454 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.571 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . . . -56.08 -70.95 0.1 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.58 -176.214 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 2.7 m-20 -60.9 -56.83 16.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.452 -174.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.531 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 10.8 mmt -60.84 -49.63 76.72 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.18 -172.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.483 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -64.14 -44.78 91.14 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.582 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.571 ' NH1' ' HA ' ' A' ' 9' ' ' ALA . 54.5 mtt85 -85.78 -1.95 57.74 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 17' ' ' GLN . 55.9 tp -95.56 -46.68 6.55 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 171.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.643 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -76.0 -20.96 57.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.373 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 31.3 tp10 -48.61 -40.54 27.88 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.776 0.798 . . . . 0.0 109.019 170.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.47 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 54.7 tt0 -60.26 -58.85 6.74 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 114.304 -1.317 . . . . 0.0 110.336 175.53 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 47.9 m95 -53.06 -38.45 62.48 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.682 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 43.3 mt-10 -67.52 -44.31 78.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.148 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.471 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -60.16 -50.0 75.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.158 177.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -58.03 -36.87 73.34 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 178.163 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.63 -50.48 72.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.411 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.73 -38.31 89.99 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.052 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.2 mt -63.02 -41.12 91.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.833 0.349 . . . . 0.0 110.546 178.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.44 -23.03 58.86 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.18 0.514 . . . . 0.0 109.883 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -72.19 -17.09 61.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.556 0.693 . . . . 0.0 109.368 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.48 21.29 35.05 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.898 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -132.43 115.83 16.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--N 1.33 -0.274 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.425 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.637 HD11 ' HE3' ' A' ' 64' ' ' MET . 3.3 tm? . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.643 ' SD ' HD12 ' A' ' 15' ' ' LEU . 21.6 ptt? -147.28 131.55 17.47 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.107 167.047 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.637 ' HE3' HD11 ' A' ' 62' ' ' LEU . 58.9 mtt -118.42 138.43 52.46 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.7 -170.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -103.83 114.31 28.47 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 168.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.563 HG21 HD13 ' A' ' 122' ' ' LEU . 21.6 t -114.39 112.03 38.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 118.007 0.367 . . . . 0.0 110.959 -172.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.659 HG23 ' HB2' ' A' ' 130' ' ' GLU . 7.9 t -98.16 123.81 42.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.06 -60.59 2.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.21 -174.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.7 t -92.8 -57.46 2.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.339 -172.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.72 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 91.25 29.64 12.16 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -168.082 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.673 ' HB3' ' HG3' ' A' ' 76' ' ' GLU . 28.9 t-20 -125.19 132.77 24.39 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 122.858 0.463 . . . . 0.0 110.325 -178.364 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.4 -17.11 34.9 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.381 2.721 . . . . 0.0 114.406 -173.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 m -81.47 139.37 35.23 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 112.069 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -41.44 -49.24 3.9 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.631 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -39.1 -41.8 0.85 Allowed 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.773 0.671 . . . . 0.0 112.495 -167.688 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.673 ' HG3' ' HB3' ' A' ' 71' ' ' ASN . 9.8 mm-40 -59.74 -70.47 0.16 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.273 -174.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.455 HG21 ' HA ' ' A' ' 102' ' ' SER . 15.2 t -61.73 -38.64 88.67 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.859 0.361 . . . . 0.0 110.648 -178.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -53.67 -62.65 1.52 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.612 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.443 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 51.9 mt-10 -71.41 -38.69 71.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.816 -173.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.48 HD12 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -66.48 -39.94 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.395 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 90.2 m -69.02 -34.54 75.42 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.5 m -57.44 -45.21 84.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.109 174.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.48 HD12 HD12 ' A' ' 80' ' ' ILE . 83.6 mt -61.13 -51.86 67.29 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.225 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.4 m0 -62.25 -27.62 69.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.525 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.19 -57.74 3.99 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 174.099 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.01 -12.72 7.53 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 115.693 -0.685 . . . . 0.0 113.672 176.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.4 m -95.92 -67.98 0.82 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 117.084 0.442 . . . . 0.0 110.862 174.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.5 mp -66.34 -56.45 11.05 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.713 -172.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -66.13 -26.45 67.45 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.176 -176.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -72.16 -30.29 64.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 0.0 109.657 175.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.0 5.9 24.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.542 175.232 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 76.32 17.8 1.95 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.333 176.207 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -78.79 91.87 4.77 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.067 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -82.79 71.96 9.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.55 0.69 . . . . 0.0 109.967 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.412 HG12 HD21 ' A' ' 109' ' ' LEU . 5.6 m -88.14 178.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.421 178.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.583 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 4.9 tp60 -109.95 142.1 41.8 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 119.731 -0.787 . . . . 0.0 109.759 171.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.414 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.06 134.94 17.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.083 -178.01 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.438 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 29.5 m-85 -116.87 134.57 54.61 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 175.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -100.02 90.56 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.827 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.39 137.02 46.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.97 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.452 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 75.26 101.97 0.11 Allowed Glycine 0 C--O 1.225 -0.433 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 -169.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.455 ' HA ' HG21 ' A' ' 77' ' ' THR . 15.2 m -60.31 -10.08 4.27 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.72 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 4.1 p-10 -100.46 -4.85 28.03 Favored 'General case' 0 C--O 1.239 0.517 0 O-C-N 121.974 -0.454 . . . . 0.0 111.179 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 75.4 mtt180 -131.89 151.94 51.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.524 0.678 . . . . 0.0 111.831 -173.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.57 136.17 51.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.209 166.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.502 ' CD1' HD21 ' A' ' 15' ' ' LEU . 4.7 tt -112.46 128.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.429 . . . . 0.0 110.809 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -118.02 145.94 44.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.967 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.583 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -141.61 147.62 37.92 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-O 121.472 0.654 . . . . 0.0 110.837 175.864 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.412 HD21 HG12 ' A' ' 95' ' ' VAL . 89.6 mt -131.93 136.02 47.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.893 -177.071 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -92.47 -31.2 15.35 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 164.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.14 110.22 22.21 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.942 -1.026 . . . . 0.0 108.361 170.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -113.45 13.42 23.17 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.303 -173.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.4 t -61.55 -20.17 62.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.757 0.313 . . . . 0.0 111.366 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -118.68 19.02 13.32 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.862 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.492 ' HB1' ' HG ' ' A' ' 62' ' ' LEU . . . -62.03 -44.93 95.65 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.01 -176.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -33.88 77.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -174.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -61.16 -46.69 89.49 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.191 0.52 . . . . 0.0 109.745 177.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -62.04 -42.28 94.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.828 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -52.99 -53.56 48.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.114 0.483 . . . . 0.0 110.181 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.442 ' HA ' HG22 ' A' ' 123' ' ' VAL . 0.8 OUTLIER -60.35 -36.44 77.99 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.035 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -65.19 -48.55 73.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 0.0 110.046 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.563 HD13 HG21 ' A' ' 66' ' ' VAL . 88.3 mt -53.6 -47.07 70.53 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.459 177.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 120' ' ' ASP . 21.3 m -79.5 -13.74 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.363 -178.271 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.9 t -74.56 2.28 10.08 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.857 0.361 . . . . 0.0 111.457 175.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -78.26 164.81 24.57 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.019 0.438 . . . . 0.0 111.586 -176.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.9 -63.66 1.07 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.04 -172.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -75.16 -5.28 43.52 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.216 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 45.7 t 61.42 104.41 0.02 OUTLIER 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.318 0.58 . . . . 0.0 109.79 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.62 133.14 45.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.845 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.659 ' HB2' HG23 ' A' ' 67' ' ' THR . 50.3 mm-40 -83.35 113.25 20.6 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.628 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.481 HG23 HG22 ' A' ' 66' ' ' VAL . 7.5 p -109.7 134.22 52.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.851 -175.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 22.9 p -122.37 143.24 49.78 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 31.6 mt -107.67 135.23 49.45 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -175.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.614 HG12 ' HD2' ' A' ' 6' ' ' TYR . 12.8 tt . . . . . 0 CA--C 1.542 0.643 0 CA-C-O 121.036 0.446 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.567 ' HA ' ' OD1' ' A' ' 7' ' ' ASN . 99.2 mtt180 -58.72 -13.52 6.21 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -177.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.47 -49.84 71.44 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.519 177.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.614 ' HD2' HG12 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -69.68 -37.61 76.71 Favored 'General case' 0 C--N 1.338 0.065 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.626 -178.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 4' ' ' ARG . 14.7 m120 -48.9 -69.24 0.12 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 176.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.24 -68.12 0.22 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.047 -177.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.34 -59.97 4.45 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.665 -171.562 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.452 ' HB3' ' O ' ' A' ' 6' ' ' TYR . 23.5 t70 -66.91 -48.17 69.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.741 -170.274 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.55 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 6.0 mmt -69.98 -47.07 63.74 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.974 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.42 81.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.97 0.414 . . . . 0.0 110.764 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -68.87 -19.51 64.24 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.167 -178.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.18 -52.52 16.17 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 169.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.44 HD23 ' O ' ' A' ' 11' ' ' MET . 4.4 mm? -69.91 -15.08 63.01 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.808 -176.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -48.41 -55.49 10.7 Favored 'General case' 0 C--O 1.247 0.95 0 CA-C-O 121.533 0.682 . . . . 0.0 111.055 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -66.09 -29.59 69.95 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.53 -178.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.465 ' CH2' ' SD ' ' A' ' 108' ' ' MET . 45.2 m95 -64.05 -41.66 97.31 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -57.91 -47.91 81.45 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.51 ' O ' HG13 ' A' ' 24' ' ' ILE . 83.7 tttt -57.23 -40.71 78.11 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.04 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -62.17 -51.64 67.03 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.727 0.299 . . . . 0.0 110.948 -175.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.67 -25.48 60.28 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.745 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -39.67 85.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.767 0.318 . . . . 0.0 110.16 171.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.2 mt -62.5 -37.82 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -65.58 -34.95 79.44 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.922 175.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -71.37 -20.28 62.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.362 0.601 . . . . 0.0 109.68 174.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.05 35.05 7.28 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.796 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -143.82 132.13 22.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 176.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.4 mm? . . . . . 0 C--O 1.238 0.459 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.415 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.453 HD13 ' HA3' ' A' ' 112' ' ' GLY . 3.0 tt . . . . . 0 C--O 1.235 0.312 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.522 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 22.7 ptp -126.41 124.54 40.41 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.155 -179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.458 ' HG2' ' CD2' ' A' ' 133' ' ' LEU . 55.6 mtt -107.68 118.03 35.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.466 -176.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.453 ' CZ ' HD12 ' A' ' 106' ' ' ILE . 9.5 m-85 -100.49 126.55 46.92 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.413 HG11 ' CH2' ' A' ' 84' ' ' TRP . 25.8 t -113.01 100.72 11.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.856 0.36 . . . . 0.0 110.303 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.649 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 34.5 m -74.31 99.01 3.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.719 175.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.597 HG11 HG21 ' A' ' 80' ' ' ILE . 58.5 t -96.4 -55.94 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.195 0.521 . . . . 0.0 110.634 -175.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.419 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 9.7 m -87.36 -63.3 1.33 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.483 -172.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 82.1 -10.62 52.68 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 -169.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.468 ' ND2' ' HD2' ' A' ' 72' ' ' PRO . 27.0 t-20 -126.52 137.53 30.57 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.468 ' HD2' ' ND2' ' A' ' 71' ' ' ASN . 18.7 Cg_endo -55.6 -17.21 16.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.876 3.051 . . . . 0.0 115.261 -171.129 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 9.8 p -49.78 100.02 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -176.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.46 ' H ' ' HG3' ' A' ' 74' ' ' GLU . 11.9 mt-10 -31.95 -44.94 0.09 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.928 1.291 . . . . 0.0 113.247 175.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.883 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.1 mptp? -51.58 -48.47 63.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.342 -166.292 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.419 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 14.7 mm-40 -58.66 -56.71 18.68 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.204 -174.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.481 HG21 ' HA ' ' A' ' 102' ' ' SER . 14.6 t -64.59 -37.13 86.5 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.559 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.91 -55.25 37.3 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 54.0 mt-10 -58.77 -55.44 35.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.769 -178.253 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.597 HG21 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -63.26 -47.4 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.499 -172.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.481 HG21 ' HB ' ' A' ' 99' ' ' ILE . 45.0 m -68.88 -31.67 70.77 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.206 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 18.9 t -68.82 -41.23 78.9 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 98.6 mt -61.21 -46.47 90.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.413 ' CH2' HG11 ' A' ' 66' ' ' VAL . 40.8 m0 -61.65 -36.58 81.19 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.841 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -59.52 -65.95 0.59 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -51.39 -28.73 21.28 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.325 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.8 m -87.82 -61.76 1.65 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.641 0.721 . . . . 0.0 111.923 -178.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.1 -53.68 46.72 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.261 0.553 . . . . 0.0 111.248 -176.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -76.76 -10.81 59.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.533 -171.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -84.92 -33.19 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 172.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.21 2.21 28.78 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.187 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 74.12 20.15 2.8 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.707 175.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -82.86 71.19 9.96 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 171.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.26 82.27 3.74 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.466 0.651 . . . . 0.0 110.665 -176.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.4 m -87.76 175.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.023 174.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.504 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 5.6 tp60 -99.77 120.68 40.12 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.03 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.696 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -119.72 125.89 49.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.719 -164.526 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -128.38 113.15 15.21 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.481 ' HB ' HG21 ' A' ' 81' ' ' THR . 6.0 tt -100.27 90.19 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.635 0.731 . . . . 0.0 109.505 175.148 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.76 125.01 51.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.498 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.01 102.01 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.147 -0.781 . . . . 0.0 111.147 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.481 ' HA ' HG21 ' A' ' 77' ' ' THR . 21.9 m -47.47 -22.14 0.42 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.453 ' HB2' HG21 ' A' ' 3' ' ' ILE . 17.4 t70 -54.34 -60.49 3.28 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.311 177.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -130.02 136.64 49.62 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.074 0.464 . . . . 0.0 111.688 -174.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -107.69 130.61 54.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 172.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.453 HD12 ' CZ ' ' A' ' 65' ' ' PHE . 7.8 tt -109.27 129.46 63.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-O 121.255 0.55 . . . . 0.0 112.267 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -112.7 122.21 47.01 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.188 172.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.465 ' SD ' ' CH2' ' A' ' 18' ' ' TRP . 61.1 mtt -101.16 133.09 46.23 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -110.62 131.65 54.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.653 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -77.5 -46.68 21.7 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 169.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -134.49 131.24 37.8 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.167 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLY . . . . . 0.453 ' HA3' HD13 ' A' ' 62' ' ' LEU . . . -120.26 56.95 0.59 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.99 -173.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.5 m -63.93 -51.17 65.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.284 0.564 . . . . 0.0 109.571 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -83.44 29.69 0.5 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.451 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.64 -49.14 77.44 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.943 0.402 . . . . 0.0 111.706 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -74.7 -23.7 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.951 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -68.43 -52.66 30.22 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.987 0.422 . . . . 0.0 109.895 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.609 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.0 tt -64.85 -40.92 90.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.279 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -58.61 -44.5 89.94 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.92 0.391 . . . . 0.0 110.119 177.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.35 -43.79 83.75 Favored 'General case' 0 C--O 1.239 0.553 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.92 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -63.54 -36.58 84.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.105 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.6 mt -66.31 -45.37 80.56 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.906 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.9 m -78.52 -12.1 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.367 -178.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.3 t -62.6 2.13 0.31 Allowed 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.493 ' HG2' HD11 ' A' ' 80' ' ' ILE . 3.7 mp0 -106.85 131.72 53.63 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 122.08 -0.387 . . . . 0.0 111.568 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -66.22 -18.07 65.12 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.909 170.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 24.2 mmm180 -58.5 -13.61 5.98 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.565 174.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 127' ' ' ARG . 49.5 t 78.25 143.7 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.891 0.744 . . . . 0.0 110.824 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.19 99.02 0.62 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.79 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.649 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 5.9 mm-40 -83.34 111.83 19.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 174.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 50.1 t -98.2 121.92 49.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.262 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 p -132.02 122.08 24.93 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.738 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.458 ' CD2' ' HG2' ' A' ' 64' ' ' MET . 21.8 mt -87.56 127.67 35.26 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.522 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 39.9 mm-40 . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 121.265 0.555 . . . . 0.0 110.096 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 CA--C 1.538 0.495 0 CA-C-O 120.919 0.39 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -58.51 -34.04 70.51 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -51.33 -50.87 58.61 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.276 0.56 . . . . 0.0 110.092 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -48.28 82.39 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.16 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 11' ' ' MET . 30.1 m-80 -51.73 -66.77 0.33 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.397 -176.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.59 -59.8 4.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.01 -64.76 0.84 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.945 0.403 . . . . 0.0 111.703 -173.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -64.95 -48.88 72.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.315 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' ' HE1' ' A' ' 65' ' ' PHE . 4.3 mmt -65.19 -44.72 87.49 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.897 -175.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.65 -51.07 66.78 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.802 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -62.59 -31.86 72.76 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.63 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.0 tp -76.41 -53.26 8.39 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.844 0.354 . . . . 0.0 111.181 177.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.652 HD12 ' SD ' ' A' ' 63' ' ' MET . 4.3 mm? -68.79 -17.41 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.046 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -60.11 -35.19 74.7 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.013 0.435 . . . . 0.0 109.873 174.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -62.42 -50.04 73.09 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.59 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 33.3 m95 -54.38 -42.71 70.68 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.797 -178.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -56.57 -54.44 45.86 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 173.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.616 ' O ' HG13 ' A' ' 24' ' ' ILE . 77.5 tttt -56.73 -35.65 68.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.358 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -64.01 -55.66 20.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.81 0.338 . . . . 0.0 111.136 -178.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -74.28 -22.52 59.26 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.572 -175.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.517 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 27.6 m-20 -75.59 -28.45 58.93 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 172.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.616 HG13 ' O ' ' A' ' 20' ' ' LYS . 63.6 mt -68.2 -32.62 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.03 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -65.58 -35.85 82.03 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.718 172.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.517 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 31.5 mm-40 -55.83 -16.83 5.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.006 0.431 . . . . 0.0 110.683 169.826 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.05 14.15 55.14 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.001 171.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -138.55 146.54 42.01 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.43 HD13 HG12 ' A' ' 24' ' ' ILE . 3.3 mm? . . . . . 0 C--O 1.236 0.375 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.819 -176.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.1 mt . . . . . 0 C--O 1.237 0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.652 ' SD ' HD12 ' A' ' 15' ' ' LEU . 44.9 mtm -140.09 110.23 6.54 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 174.614 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.656 ' HG2' HD23 ' A' ' 133' ' ' LEU . 63.0 mtt -110.3 133.04 53.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.401 -171.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.595 ' HE1' ' SD ' ' A' ' 11' ' ' MET . 68.0 m-85 -95.28 134.36 38.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 168.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 20.7 t -126.62 106.95 16.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.486 HG23 ' HB2' ' A' ' 130' ' ' GLU . 3.0 t -91.44 110.69 22.0 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.15 -60.86 2.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.068 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 10.8 m -71.76 -44.6 63.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.705 -173.346 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.678 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 69.08 2.96 34.38 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.238 -0.506 . . . . 0.0 111.852 -172.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.515 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 53.3 t30 -126.25 132.26 24.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.516 ' O ' ' HB3' ' A' ' 102' ' ' SER . 10.4 Cg_endo -50.79 -16.52 2.45 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 123.556 2.837 . . . . 0.0 113.941 -179.113 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.8 p -64.74 90.96 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.988 0.423 . . . . 0.0 110.615 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -53.76 -30.57 45.03 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.015 -177.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -40.4 -46.35 2.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.469 0.708 . . . . 0.0 112.515 -178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.437 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 60.8 mm-40 -63.28 -49.95 72.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.455 -177.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.478 ' HA ' HG22 ' A' ' 80' ' ' ILE . 91.8 m -62.82 -34.78 78.03 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.763 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.96 -51.87 67.43 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.501 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.39 -47.21 80.06 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.293 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.542 HD12 HD12 ' A' ' 83' ' ' LEU . 10.9 tp -65.28 -41.78 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.029 -0.269 . . . . 0.0 110.927 -177.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.0 m -64.73 -34.05 77.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.935 0.398 . . . . 0.0 110.409 177.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 t -60.39 -44.48 95.63 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.542 HD12 HD12 ' A' ' 80' ' ' ILE . 84.2 mt -59.01 -44.42 91.69 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.018 175.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -56.64 -38.88 72.75 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.752 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -63.96 -56.34 15.87 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.72 -15.65 13.51 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.624 -0.717 . . . . 0.0 114.02 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.3 m -96.37 -65.24 0.98 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.574 0.687 . . . . 0.0 111.337 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.38 -51.57 68.94 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.353 -175.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -72.77 -20.16 61.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -67.54 -36.2 80.53 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 172.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.8 1.72 48.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.408 175.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 67.7 31.53 5.93 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.408 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -77.76 100.74 6.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.159 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -77.38 89.66 3.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.404 0.621 . . . . 0.0 110.617 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.1 m -119.52 157.32 21.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.241 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.59 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.8 tp60 -101.92 103.92 14.6 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.561 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -107.94 135.79 48.73 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.919 -177.981 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.404 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 17.4 m-85 -120.71 121.28 37.92 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.0 tt -92.18 88.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 122.139 0.971 . . . . 0.0 109.268 174.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.28 134.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 177.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 99.9 103.06 2.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -166.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.516 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 16.4 m -37.3 -51.32 1.06 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -171.139 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.678 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.2 p-10 -101.05 -4.78 26.76 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.795 0.331 . . . . 0.0 111.441 -177.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -113.44 126.18 55.05 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.33 -168.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -115.24 130.77 57.0 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 170.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.46 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.9 tt -108.74 146.43 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.832 0.349 . . . . 0.0 111.445 -178.037 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -132.65 126.96 33.84 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.908 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.481 ' HG3' ' HG2' ' A' ' 63' ' ' MET . 3.6 mpp? -115.35 122.58 46.31 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 174.229 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 109' ' ' LEU . 5.7 mp -109.14 139.63 43.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.566 -178.232 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -104.2 5.93 35.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.27 0.557 . . . . 0.0 109.782 174.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -137.45 146.73 44.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.388 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -125.01 20.66 6.68 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.36 -174.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.6 m -76.74 -46.38 25.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.411 0.624 . . . . 0.0 110.127 179.467 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -105.48 22.44 15.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.076 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.29 -49.15 78.75 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.163 0.506 . . . . 0.0 111.611 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -23.83 56.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.115 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.33 -45.21 60.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.643 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.4 tt -66.26 -39.89 85.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -57.6 -41.01 80.36 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.122 0.487 . . . . 0.0 109.981 173.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.471 ' HA ' HG22 ' A' ' 123' ' ' VAL . 31.2 t70 -63.54 -41.15 98.47 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.587 178.016 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -62.51 -36.4 82.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.064 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 92.7 mt -66.43 -49.73 65.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.863 178.109 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.471 HG22 ' HA ' ' A' ' 120' ' ' ASP . 19.3 m -72.05 -13.44 16.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.932 0.396 . . . . 0.0 110.905 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 25.2 t -69.85 2.2 3.64 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.708 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -88.23 92.31 9.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.394 0.616 . . . . 0.0 110.192 -178.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -49.28 -40.96 36.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.72 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.45 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 98.1 mtt180 -56.6 -48.23 77.88 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 127' ' ' ARG . 51.3 t 165.8 138.12 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.461 0.475 . . . . 0.0 110.191 -174.703 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 179.54 110.69 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.495 0.497 . . . . 0.0 110.935 175.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLU . . . . . 0.486 ' HB2' HG23 ' A' ' 67' ' ' THR . 35.9 mt-10 -108.02 116.76 32.55 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 172.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.54 138.25 39.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.871 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.5 m -149.31 153.54 37.64 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.656 HD23 ' HG2' ' A' ' 64' ' ' MET . 70.7 mt -85.92 156.02 20.68 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.647 0.26 . . . . 0.0 110.465 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.586 ' HG2' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.384 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 175.375 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.611 HG12 ' HB3' ' A' ' 6' ' ' TYR . 14.0 tt . . . . . 0 CA--C 1.537 0.448 0 CA-C-O 121.95 0.881 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -65.97 -16.89 64.29 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.426 -174.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -57.39 -46.34 83.54 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.611 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.7 OUTLIER -62.6 -47.13 85.15 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.025 174.75 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.419 ' O ' ' HB2' ' A' ' 11' ' ' MET . 4.2 m-20 -54.0 -68.05 0.21 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -178.4 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -50.02 -64.59 0.76 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.255 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 13' ' ' ARG . . . -57.56 -62.53 1.72 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.277 -172.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 16.6 t70 -64.09 -63.39 1.17 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.56 -174.749 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 14.0 mmt -54.75 -55.75 26.57 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.815 0.34 . . . . 0.0 110.846 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.09 -53.78 10.2 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.3 -173.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 9' ' ' ALA . 35.5 mtt180 -80.13 -8.2 59.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.746 -167.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.534 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 52.5 tp -98.96 -52.98 3.4 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 171.672 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.26 -11.4 60.9 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.584 0.23 . . . . 0.0 111.358 -175.38 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -48.47 -48.94 37.42 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.18 171.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 20.5 pt20 -57.43 -38.16 73.95 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.382 -175.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -64.63 -39.22 93.32 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.948 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.77 -47.38 85.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.3 ttpm? -63.32 -33.28 75.17 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.214 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -63.67 -48.37 77.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 109.946 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.77 -37.82 71.62 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.672 175.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 72.7 m-20 -68.43 -40.33 81.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.407 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.8 mt -62.51 -38.37 81.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 CA-C-O 121.363 0.601 . . . . 0.0 109.662 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -70.91 -28.69 64.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.237 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 10.0 tp10 -64.29 -12.07 38.05 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.127 172.047 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.13 21.87 34.27 Favored Glycine 0 C--N 1.333 0.381 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.687 173.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -152.03 153.06 33.24 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.184 0.516 . . . . 0.0 111.469 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.168 175.213 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 133' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 121.416 0.627 . . . . 0.0 112.468 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.589 ' HB2' ' HB3' ' A' ' 134' ' ' GLU . 35.3 mtp -126.74 148.67 49.87 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.54 ' HE1' ' O ' ' A' ' 115' ' ' ALA . 62.4 mtt -130.79 118.79 21.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -175.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.469 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 25.1 m-85 -98.95 97.41 8.58 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 171.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.538 HG21 HD13 ' A' ' 122' ' ' LEU . 22.0 t -88.76 110.42 21.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.876 0.369 . . . . 0.0 111.466 -172.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.0 m -74.24 96.04 2.73 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.516 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.72 HG11 HG21 ' A' ' 80' ' ' ILE . 46.3 t -90.42 -48.46 14.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.314 0.578 . . . . 0.0 110.775 -174.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.836 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 43.7 t -90.97 -61.04 1.75 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.22 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 75.91 -3.2 52.09 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -168.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASN . . . . . 0.403 ' ND2' ' HD2' ' A' ' 72' ' ' PRO . 17.4 t-20 -119.78 134.38 23.91 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 109.695 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.403 ' HD2' ' ND2' ' A' ' 71' ' ' ASN . 19.5 Cg_endo -57.16 -17.74 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.66 2.906 . . . . 0.0 114.832 -173.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.517 HG22 ' HD3' ' A' ' 75' ' ' LYS . 1.1 m -78.21 145.39 35.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.311 0.505 . . . . 0.0 110.343 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -85.27 -22.68 28.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -163.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.521 ' H ' ' HD3' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.06 -42.04 17.98 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.503 0.668 . . . . 0.0 110.706 -173.877 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -65.62 0.57 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.419 -175.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.417 HG21 ' HA ' ' A' ' 102' ' ' SER . 15.3 t -63.73 -37.13 86.19 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.784 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.24 -58.31 9.08 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.136 0.493 . . . . 0.0 110.524 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -60.69 -46.82 88.91 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.433 -177.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.72 HG21 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -68.16 -40.18 82.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.406 -175.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 97.4 m -64.96 -35.96 82.87 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.1 t -62.22 -42.61 99.46 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.983 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.99 -49.02 79.14 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.194 0.521 . . . . 0.0 110.673 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.424 ' HZ3' ' HB3' ' A' ' 105' ' ' ALA . 43.4 m0 -61.16 -41.01 96.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.144 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -55.49 -46.05 76.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 109.881 172.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -68.5 -22.37 74.94 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.747 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 m -96.28 -68.25 0.81 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.924 0.392 . . . . 0.0 111.858 -179.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 88' ' ' LEU . 7.3 mp -63.88 -45.89 87.36 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.85 -172.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -76.82 -0.39 23.78 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.769 0.318 . . . . 0.0 111.542 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -88.29 -36.09 16.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.28 -10.34 59.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.699 171.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 57.7 71.4 0.58 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.636 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -89.17 161.18 16.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.734 175.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -87.32 27.11 1.11 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.058 -177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.579 HG12 ' HG ' ' A' ' 109' ' ' LEU . 29.5 m -86.53 132.94 31.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.298 0.571 . . . . 0.0 111.219 -176.126 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -99.95 118.71 36.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 173.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.759 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -127.13 140.86 51.96 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.832 -172.106 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -125.77 147.03 49.52 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.492 176.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.4 tt -112.76 98.36 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.538 0.685 . . . . 0.0 109.638 177.044 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.8 p -149.16 138.66 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.669 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 77.97 102.46 0.19 Allowed Glycine 0 C--O 1.226 -0.363 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.417 ' HA ' HG21 ' A' ' 77' ' ' THR . 14.0 m -49.32 -32.37 11.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -173.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.836 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 10.3 p-10 -74.48 -16.81 60.84 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -177.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 53.9 mtt85 -134.44 156.4 48.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.88 0.848 . . . . 0.0 112.922 -169.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.424 ' HB3' ' HZ3' ' A' ' 84' ' ' TRP . . . -135.77 142.29 44.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 107.703 163.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 4.4 tt -117.15 137.39 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.54 -172.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -131.69 142.27 49.78 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.6 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.444 ' HG2' ' HE3' ' A' ' 63' ' ' MET . 70.6 mtp -127.51 119.65 26.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 177.684 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.579 ' HG ' HG12 ' A' ' 95' ' ' VAL . 5.0 mp -98.91 119.89 38.43 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.37 -32.65 58.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 175.122 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -112.64 111.55 22.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.593 169.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -85.3 22.94 8.99 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.309 -0.472 . . . . 0.0 112.642 -178.087 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -60.57 -49.06 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.993 0.425 . . . . 0.0 110.874 -179.144 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.405 ' O ' HG22 ' A' ' 118' ' ' ILE . 40.2 p90 -97.36 29.96 3.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.735 -178.005 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.54 ' O ' ' HE1' ' A' ' 64' ' ' MET . . . -56.12 -53.01 62.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.732 -178.007 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -75.54 -22.02 57.41 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.17 -177.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -68.3 -56.04 10.0 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 175.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.661 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.4 tt -59.47 -41.55 84.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.796 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.499 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 65.7 tttm -55.06 -48.58 73.29 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.917 0.389 . . . . 0.0 110.337 177.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.04 -46.64 85.02 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.277 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -61.84 -41.29 97.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.47 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 78.7 mt -61.58 -41.2 97.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.664 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 27.7 m -87.29 -4.83 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.575 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.3 m -70.48 2.4 4.0 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.51 0.324 . . . . 0.0 111.736 174.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.526 ' NE2' HG12 ' A' ' 80' ' ' ILE . 46.2 mt-30 -59.69 162.93 4.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.404 0.621 . . . . 0.0 111.777 -177.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -85.97 -42.76 13.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.091 -0.959 . . . . 0.0 108.789 176.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -71.04 -22.82 62.09 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.478 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.3 m 72.86 137.39 0.05 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.919 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -137.72 156.08 48.39 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.542 -178.172 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -109.24 130.48 55.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.007 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.442 HG22 HG13 ' A' ' 66' ' ' VAL . 58.2 t -109.22 124.36 65.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.896 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.469 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 40.3 p -102.93 137.38 41.21 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 174.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 62' ' ' LEU . 50.1 mt -102.22 149.77 23.97 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.421 -172.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.589 ' HB3' ' HB2' ' A' ' 63' ' ' MET . 3.2 tm-20 . . . . . 0 C--O 1.234 0.266 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 3' ' ' ILE . 12.7 tt . . . . . 0 CA--C 1.537 0.45 0 CA-C-O 121.516 0.674 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -58.86 -49.72 76.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.93 -173.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -58.52 -42.69 88.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.469 -176.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.29 -48.83 80.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.077 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.621 ' HA ' ' SD ' ' A' ' 11' ' ' MET . 21.9 m-80 -60.38 -69.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.982 -179.097 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -49.53 -66.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.17 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.71 -60.37 3.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.914 -172.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -70.7 -44.54 66.72 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.155 0.502 . . . . 0.0 110.788 -169.116 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.621 ' SD ' ' HA ' ' A' ' 7' ' ' ASN . 71.0 mtp -74.51 -34.71 63.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.749 -172.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.54 -34.55 76.04 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.859 173.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 -62.8 -39.24 93.66 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.756 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.406 ' CD1' HD22 ' A' ' 15' ' ' LEU . 2.9 pp -84.05 -32.04 25.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.035 179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 11' ' ' MET . 3.5 mm? -69.28 -22.6 63.8 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.773 0.321 . . . . 0.0 110.273 174.359 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -48.8 -39.38 25.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.289 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -60.16 -46.32 90.07 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.347 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.484 ' CH2' ' HG3' ' A' ' 108' ' ' MET . 57.9 m95 -60.79 -42.14 96.98 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.179 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.06 -47.36 86.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.566 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.5 tttt -62.99 -34.21 77.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.51 178.169 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.19 -54.22 48.45 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.453 0.168 . . . . 0.0 111.117 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.5 p-10 -70.65 -26.71 63.58 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.093 -178.241 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 11.5 m-20 -62.3 -48.43 79.91 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.071 0.462 . . . . 0.0 110.472 172.069 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 20' ' ' LYS . 80.7 mt -59.66 -40.39 82.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.753 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -67.53 -30.73 70.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.399 178.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 74.3 mm-40 -60.43 -15.37 25.82 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 110.447 171.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.22 34.65 6.63 Favored Glycine 0 C--N 1.333 0.377 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.414 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -158.66 149.76 20.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.758 0.313 . . . . 0.0 110.247 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.437 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 63' ' ' MET . . . . . 0.402 ' SD ' HD12 ' A' ' 15' ' ' LEU . 32.5 mtm -132.45 128.71 38.06 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 169.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 60.2 mtt -110.48 122.43 47.7 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.929 0.395 . . . . 0.0 112.049 -171.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -95.62 106.68 18.8 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 169.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.407 HG21 HD13 ' A' ' 122' ' ' LEU . 23.3 t -99.67 112.83 33.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.67 0.272 . . . . 0.0 110.768 -174.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.81 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 25.8 m -85.48 109.66 18.64 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.616 HG11 HG21 ' A' ' 80' ' ' ILE . 42.7 t -94.66 -62.97 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 111.641 -171.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 52.8 p -93.6 -48.06 6.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.201 -173.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 77.66 9.24 87.01 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -165.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -126.22 129.22 24.27 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 123.618 0.767 . . . . 0.0 109.342 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.477 ' O ' ' HB3' ' A' ' 102' ' ' SER . 47.8 Cg_endo -65.64 -18.45 58.87 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.18 2.587 . . . . 0.0 114.816 -169.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.442 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.7 m -63.93 123.69 19.61 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.216 0.462 . . . . 0.0 110.944 -175.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -50.66 -29.04 10.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.759 0.824 . . . . 0.0 112.711 -175.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HG3' HG22 ' A' ' 73' ' ' THR . 25.2 mtpp -38.06 -60.74 0.72 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.447 0.699 . . . . 0.0 112.702 -176.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.98 -59.07 6.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.738 -171.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.6 t -60.65 -43.03 98.09 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 123.119 0.262 . . . . 0.0 110.999 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.83 -61.91 2.26 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.957 0.408 . . . . 0.0 111.081 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.1 -50.22 74.22 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.053 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.616 HG21 HG11 ' A' ' 68' ' ' VAL . 7.5 tp -64.45 -41.81 93.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.673 -173.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -66.34 -34.37 77.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.692 0.282 . . . . 0.0 110.652 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 85' ' ' GLN . 22.7 t -60.8 -43.45 98.14 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.331 0.586 . . . . 0.0 109.545 174.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.2 mt -64.29 -37.25 86.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.161 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' TRP . . . . . 0.586 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 46.3 m0 -67.11 -29.28 68.98 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.419 178.238 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.501 ' HB3' ' O ' ' A' ' 82' ' ' SER . 30.8 tt0 -62.51 -55.21 29.67 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.2 -26.95 51.31 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.429 -0.805 . . . . 0.0 113.432 175.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.3 m -86.87 -70.39 0.61 Allowed 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.387 -0.478 . . . . 0.0 111.411 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -53.6 -50.2 66.14 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -173.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.44 ' CD2' ' HA ' ' A' ' 85' ' ' GLN . 57.0 m-85 -77.25 -24.15 51.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -170.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -82.38 -19.97 38.11 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.73 10.41 7.65 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.565 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 74.79 15.1 3.23 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.729 0.812 . . . . 0.0 112.486 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -89.79 153.88 20.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -149.19 77.44 1.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.579 0.704 . . . . 0.0 110.039 176.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 29.4 m -89.36 176.59 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.831 174.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.813 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 5.8 tp60 -100.3 133.77 44.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 173.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.61 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.04 133.28 35.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.93 -164.524 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.417 ' O ' HG22 ' A' ' 106' ' ' ILE . 77.4 m-85 -137.85 132.66 32.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 176.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -89.14 88.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.816 0.817 . . . . 0.0 109.298 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -136.96 137.9 46.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.777 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.96 102.09 1.13 Allowed Glycine 0 C--O 1.222 -0.618 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -166.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 15.5 m -46.9 -36.11 7.2 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.444 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 16.9 p-10 -101.18 9.84 41.48 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.81 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 86.3 mtt85 -142.96 159.87 41.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.635 0.731 . . . . 0.0 112.34 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.53 144.69 51.57 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.0 168.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.417 HG22 ' O ' ' A' ' 98' ' ' PHE . 13.2 tt -114.76 141.64 30.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 120.999 0.428 . . . . 0.0 111.189 -177.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -135.21 106.87 6.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.165 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.813 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.3 OUTLIER -93.47 121.6 35.03 Favored 'General case' 0 C--O 1.243 0.752 0 CA-C-O 121.339 0.59 . . . . 0.0 110.118 176.12 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.443 HD12 ' N ' ' A' ' 109' ' ' LEU . 5.5 mp -105.45 120.98 42.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.153 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -54.66 15.61 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -112.51 111.4 22.2 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.42 174.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.27 56.6 4.77 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.249 -0.5 . . . . 0.0 113.183 -175.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.6 m -69.05 -29.38 67.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.868 0.366 . . . . 0.0 111.162 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -124.6 29.32 6.3 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.27 0.557 . . . . 0.0 110.905 -177.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.72 -43.11 90.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.716 -178.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 16.6 m95 -72.55 -34.43 67.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.724 -175.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.88 -51.29 65.27 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.506 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.554 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.1 tt -63.09 -38.64 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 178.242 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 23.2 ttpp -53.04 -57.99 8.5 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.126 0.488 . . . . 0.0 110.623 176.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.691 ' HA ' HG22 ' A' ' 123' ' ' VAL . 33.2 m-20 -68.18 -26.56 65.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.211 -176.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -65.21 -43.07 92.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.8 mt -72.69 -37.75 67.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.61 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' HA ' ' A' ' 120' ' ' ASP . 14.1 m -73.37 -26.03 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.803 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 18.7 t -85.61 3.69 39.66 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.74 176.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.586 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 6.3 tp-100 -65.54 158.64 26.49 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.937 -170.43 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.7 -68.7 0.28 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.722 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -73.09 4.86 3.87 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.553 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.5 m 71.42 149.54 0.09 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.317 0.647 . . . . 0.0 111.398 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 68' ' ' VAL . . . -171.05 103.76 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.402 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -91.27 130.92 37.08 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.301 0.572 . . . . 0.0 110.515 -179.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 45.5 t -92.01 144.26 9.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.443 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 85.9 m -124.99 136.11 53.42 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 90.6 mt -96.51 125.87 41.3 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 110.573 -174.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.236 0.353 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.479 ' O ' ' HB2' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.485 1.905 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 1' ' ' GLY . 18.1 t70 161.32 123.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 -172.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.455 HD13 ' HB2' ' A' ' 103' ' ' ASP . 0.6 OUTLIER 72.62 -28.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.517 0.727 . . . . 0.0 112.649 174.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -54.57 -22.68 13.92 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.684 0.278 . . . . 0.0 111.625 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.36 -45.14 88.81 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.518 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -67.95 -40.66 83.2 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.676 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.559 ' O ' ' HB2' ' A' ' 11' ' ' MET . 81.0 m-20 -51.12 -69.05 0.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.641 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -53.49 -64.23 0.89 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.295 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.56 -58.69 4.26 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.302 -172.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.506 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 5.8 m-20 -70.17 -34.69 73.3 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -171.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.559 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 29.8 mmt -68.96 -41.55 77.84 Favored 'General case' 0 C--O 1.227 -0.132 0 C-N-CA 119.691 -0.804 . . . . 0.0 109.243 176.076 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.05 -49.75 68.29 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -66.49 -39.56 88.8 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.298 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.497 HD21 ' HD2' ' A' ' 98' ' ' PHE . 57.4 tp -66.9 -51.46 55.07 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.877 0.37 . . . . 0.0 110.891 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.542 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -69.99 -29.48 66.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.259 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.29 -34.98 66.98 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.061 0.458 . . . . 0.0 110.169 177.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -62.19 -53.02 61.23 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.89 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -57.74 -36.14 71.67 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.987 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -61.5 -50.04 74.3 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.513 ' O ' HG13 ' A' ' 24' ' ' ILE . 31.8 ttmt -65.4 -35.24 80.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.343 -177.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -66.22 -44.93 82.42 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.867 0.365 . . . . 0.0 110.043 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -61.63 -33.5 74.05 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.894 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.27 -42.1 72.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.952 175.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 20' ' ' LYS . 71.5 mt -61.11 -36.6 73.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -70.09 -35.1 73.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.482 175.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.88 -24.63 66.1 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.26 24.36 22.14 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.458 -0.792 . . . . 0.0 114.042 174.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -159.17 156.8 29.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 117.062 0.431 . . . . 0.0 110.454 172.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.371 -178.164 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.4 mt . . . . . 0 N--CA 1.468 0.443 0 CA-C-O 121.385 0.612 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.542 ' SD ' HD12 ' A' ' 15' ' ' LEU . 55.1 mtm -138.12 145.34 41.51 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 170.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.544 ' HG2' HD23 ' A' ' 133' ' ' LEU . 64.3 mtt -128.37 134.2 48.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.886 0.374 . . . . 0.0 111.829 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 134' ' ' GLU . 43.7 m-85 -98.03 121.65 40.21 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 166.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 39.3 t -116.38 104.16 16.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.595 0.236 . . . . 0.0 110.777 -174.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.473 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 86.9 m -72.41 107.66 5.1 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 174.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.757 HG11 HG21 ' A' ' 80' ' ' ILE . 42.3 t -101.09 -62.92 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.718 0.294 . . . . 0.0 111.204 -173.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.7 m -92.62 -45.81 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.867 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.66 10.69 67.71 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.799 -0.921 . . . . 0.0 110.799 -169.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.488 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 30.3 t30 -126.11 129.23 24.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 123.615 0.766 . . . . 0.0 109.096 -177.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.488 ' HD2' ' OD1' ' A' ' 71' ' ' ASN . 13.8 Cg_endo -55.15 -18.15 17.02 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.549 2.833 . . . . 0.0 114.225 -176.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 75' ' ' LYS . 24.4 m -58.77 93.06 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.919 0.39 . . . . 0.0 111.611 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.461 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 2.6 mp0 -50.81 -23.66 2.92 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.289 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.58 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -59.61 -41.22 89.88 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.757 -174.727 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.26 -53.53 55.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.679 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.519 ' HA ' HG22 ' A' ' 80' ' ' ILE . 17.5 m -62.77 -32.88 74.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.54 -60.09 4.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.316 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 42.0 mt-10 -55.71 -55.82 27.71 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.575 0.703 . . . . 0.0 110.867 -178.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.757 HG21 HG11 ' A' ' 68' ' ' VAL . 10.7 tp -65.1 -48.93 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.073 -171.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.489 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 89.8 m -63.56 -29.83 71.03 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 122.244 -0.285 . . . . 0.0 110.662 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.3 t -59.41 -46.68 88.04 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.512 HD12 HD12 ' A' ' 80' ' ' ILE . 55.6 mt -58.39 -48.48 80.48 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.092 175.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.512 ' NE1' HG13 ' A' ' 80' ' ' ILE . 28.7 m0 -59.27 -39.45 82.93 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.098 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.5 mt-30 -64.68 -58.06 7.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -53.42 -22.26 15.38 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-N 115.71 -0.677 . . . . 0.0 113.91 176.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -88.39 -61.72 1.65 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 117.453 0.627 . . . . 0.0 111.306 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.58 -47.51 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.808 -173.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.416 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 71.3 m-85 -78.69 1.12 24.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.276 -176.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 48.8 t30 -89.34 -37.6 14.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 177.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.44 2.36 48.03 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.637 176.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.4 t30 60.87 89.32 0.08 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.268 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -114.93 140.44 49.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.531 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.66 66.67 1.08 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 110.408 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.9 m -134.71 163.51 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.832 -177.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -139.96 148.83 42.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 173.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.609 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -133.76 137.58 45.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.523 0.202 . . . . 0.0 110.591 -173.531 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.497 ' HD2' HD21 ' A' ' 14' ' ' LEU . 22.9 m-85 -124.77 136.28 53.72 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.3 tt -109.04 89.95 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.463 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.3 p -132.07 125.37 54.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.254 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.518 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 70.91 100.99 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.126 -174.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.461 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 3.0 m -56.61 -14.88 3.56 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -173.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.455 ' HB2' HD13 ' A' ' 3' ' ' ILE . 19.7 t70 -57.57 -51.36 69.78 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 46.2 mtt180 -134.36 132.39 39.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.614 -174.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -96.21 136.95 35.99 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 168.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.628 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.9 tt -105.62 136.95 37.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.131 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.434 ' CZ ' ' HE3' ' A' ' 84' ' ' TRP . 25.3 m-85 -132.09 116.98 17.73 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.022 -176.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.628 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.1 mpp? -100.45 121.03 40.88 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.262 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.451 HD12 ' N ' ' A' ' 109' ' ' LEU . 4.9 mp -104.31 119.74 39.64 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.455 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 19.0 mmm-85 -82.36 -16.17 50.15 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -126.72 126.35 43.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.613 174.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.73 10.53 59.04 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 121.137 -0.554 . . . . 0.0 113.502 -175.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.1 m -63.72 -50.53 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.247 0.524 . . . . 0.0 110.319 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -91.93 24.59 3.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.681 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.28 -53.95 52.43 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.087 0.47 . . . . 0.0 111.313 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -71.71 -17.08 62.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.824 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -74.91 -49.96 18.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.241 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 5.1 tt -62.97 -44.91 99.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -55.15 -45.43 75.68 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.478 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.47 -42.95 93.21 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.351 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.01 -39.27 89.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.623 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 33.5 mt -68.51 -38.12 80.64 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.175 -178.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 18.8 m -84.28 -16.88 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.24 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.1 t -75.53 1.57 13.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.399 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -87.71 160.54 18.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.875 0.369 . . . . 0.0 111.53 -173.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -52.48 -66.8 0.32 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.427 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -71.94 -21.37 61.62 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.894 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.8 m 68.68 134.14 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.167 0.587 . . . . 0.0 111.581 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.441 ' HB3' ' HB3' ' A' ' 122' ' ' LEU . . . -100.65 147.56 25.84 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.423 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.473 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 38.7 mt-10 -99.83 117.72 34.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.113 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 29.9 t -110.01 134.15 53.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.384 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 24.1 p -137.72 145.73 42.88 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.622 ' HB2' ' HG2' ' A' ' 137' ' ' MET . 79.1 mt -86.51 158.9 19.45 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.636 0.255 . . . . 0.0 110.654 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -76.57 141.3 41.18 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.93 -179.913 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 70.8 -80.46 0.45 Allowed Glycine 0 CA--C 1.518 0.275 0 CA-C-N 116.329 -0.396 . . . . 0.0 112.901 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -132.68 152.67 51.63 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 122.754 0.422 . . . . 0.0 110.467 -176.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.622 ' HG2' ' HB2' ' A' ' 133' ' ' LEU . 73.3 mtp -115.54 142.35 46.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.133 177.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.441 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 84.3 m-85 -76.35 -43.85 3.43 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.879 176.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.441 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 76.2 Cg_endo -83.03 149.23 13.63 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.102 1.868 . . . . 0.0 112.016 173.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 78.55 42.6 13.69 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 121.174 -0.536 . . . . 0.0 112.31 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 96.5 mttt . . . . . 0 C--O 1.234 0.285 0 N-CA-C 110.521 -0.177 . . . . 0.0 110.521 178.581 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.73 0 N-CA-C 112.091 -0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -167.78 -41.26 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.168 0.509 . . . . 0.0 110.516 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.792 HG12 ' HB3' ' A' ' 6' ' ' TYR . 13.6 tt -111.03 35.26 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-O 122.028 0.918 . . . . 0.0 110.126 -175.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.518 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 72.0 ttt-85 -63.75 -24.11 67.63 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.006 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.21 -42.55 99.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.362 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.792 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -57.94 -47.06 84.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.374 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.527 ' O ' ' HB2' ' A' ' 11' ' ' MET . 22.2 m-80 -47.52 -70.63 0.09 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.311 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.56 -61.95 2.13 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.996 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -57.24 -68.94 0.18 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.466 -174.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 4.5 m-20 -61.3 -48.69 80.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.257 -0.402 . . . . 0.0 112.07 -173.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.536 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 7.5 mmt -59.67 -46.38 89.22 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.273 -175.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.22 80.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.006 0.431 . . . . 0.0 111.251 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 86.8 mtt180 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.255 -174.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 15' ' ' LEU . 4.4 pp -89.25 -29.57 19.13 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.369 175.074 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.1 OUTLIER -63.71 -30.94 71.98 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 175.469 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -48.16 -42.06 28.54 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.914 177.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -62.1 -52.54 63.45 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.403 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.522 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 48.0 m95 -62.35 -39.4 92.98 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.376 -176.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.69 -48.22 80.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.654 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.535 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.3 tttt -62.11 -48.0 82.13 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.032 -178.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -44.93 86.93 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.132 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -57.6 -45.14 85.66 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.073 0.463 . . . . 0.0 110.04 176.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -62.2 -41.52 98.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.954 177.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 20' ' ' LYS . 91.1 mt -60.59 -40.86 85.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.196 0.522 . . . . 0.0 109.999 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -67.19 -31.61 72.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.813 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.33 -10.65 17.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.324 0.583 . . . . 0.0 110.198 172.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.93 33.02 7.57 Favored Glycine 0 CA--C 1.518 0.227 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.991 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -159.46 147.23 17.27 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 171.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.8 mm? . . . . . 0 C--O 1.235 0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.013 -175.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.626 HD11 HD22 ' A' ' 133' ' ' LEU . 44.2 tp . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.498 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 79.8 mtp -135.08 135.11 40.98 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 166.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.527 ' SD ' HD11 ' A' ' 109' ' ' LEU . 86.9 mtp -115.84 119.38 35.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.845 0.355 . . . . 0.0 111.397 -171.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 49.6 m-85 -95.16 123.18 38.52 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.454 HG21 HD13 ' A' ' 122' ' ' LEU . 43.2 t -124.04 109.06 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 117.794 0.27 . . . . 0.0 110.939 -173.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.466 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 28.3 m -74.0 98.49 3.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.641 HG11 HG21 ' A' ' 80' ' ' ILE . 11.4 t -87.63 -58.42 3.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.296 -171.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.614 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 34.7 t -89.92 -58.87 2.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.993 -174.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 88.41 -10.76 70.27 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.444 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 29.1 t-20 -122.98 132.62 24.27 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.938 0.495 . . . . 0.0 109.7 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 49.4 Cg_exo -56.99 -16.17 19.76 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.139 3.226 . . . . 0.0 115.639 -172.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 p -52.26 110.68 0.52 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.467 0.576 . . . . 0.0 112.16 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 35.8 mt-10 -55.15 -23.95 23.99 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.715 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -42.39 -62.45 0.96 Allowed 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.006 176.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.408 ' O ' HG22 ' A' ' 80' ' ' ILE . 9.5 mm-40 -56.67 -55.46 33.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.195 -172.199 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 102' ' ' SER . 11.5 t -63.6 -46.18 86.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.694 -173.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.401 ' N ' HG23 ' A' ' 77' ' ' THR . 37.3 tt0 -61.05 -49.35 77.72 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.886 0.375 . . . . 0.0 110.182 -177.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -62.62 -52.79 61.97 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.475 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.641 HG21 HG11 ' A' ' 68' ' ' VAL . 10.9 tp -67.16 -41.73 87.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.228 -174.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.9 m -66.53 -31.04 71.5 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.673 0.273 . . . . 0.0 110.536 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -63.64 -46.52 85.32 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.8 mt -59.66 -37.5 78.91 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.35 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.402 ' HH2' HG22 ' A' ' 68' ' ' VAL . 48.6 m0 -64.4 -44.35 91.56 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.484 177.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.51 -59.53 4.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.57 -62.16 4.2 Favored Glycine 0 CA--C 1.522 0.477 0 CA-C-N 115.806 -0.633 . . . . 0.0 113.139 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.1 m -58.84 -57.34 13.47 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.36 -46.69 89.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.929 0.395 . . . . 0.0 111.458 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -72.35 -27.84 62.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.125 -177.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -75.7 -28.19 58.53 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 110.064 177.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 3.63 51.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.287 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.3 t30 62.76 75.94 0.38 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.672 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -107.67 122.17 46.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.086 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -81.24 26.49 0.45 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.227 0.537 . . . . 0.0 110.617 -176.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 m -92.05 157.44 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.906 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -112.85 154.97 25.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.407 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -146.95 138.15 24.05 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.553 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -122.11 151.5 40.85 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.867 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -121.14 90.2 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.636 0.731 . . . . 0.0 110.697 -175.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.9 p -128.82 129.64 68.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 174.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.415 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 80.67 101.32 0.32 Allowed Glycine 0 C--O 1.226 -0.378 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -170.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.5 ' O ' ' HB ' ' A' ' 77' ' ' THR . 15.3 m -62.55 -9.11 7.67 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -169.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.614 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 16.1 p-10 -96.42 -18.98 19.52 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 122.113 -0.367 . . . . 0.0 111.335 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.493 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 49.9 ttt180 -137.88 132.27 32.24 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.983 -172.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.22 153.51 22.04 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.423 HG23 ' HE1' ' A' ' 108' ' ' MET . 11.3 tt -124.93 136.27 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 120.844 0.354 . . . . 0.0 111.269 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 64' ' ' MET . 13.4 m-85 -117.96 139.02 51.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.751 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.522 ' HG2' ' CH2' ' A' ' 18' ' ' TRP . 1.5 mpt? -109.96 115.92 30.67 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.604 178.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.56 HD12 HD23 ' A' ' 62' ' ' LEU . 15.4 mt -126.23 103.4 7.66 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.495 0.497 . . . . 0.0 111.502 -174.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mtp-105 -99.26 5.61 46.57 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 122.076 0.941 . . . . 0.0 108.502 165.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -146.85 124.09 11.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.026 -1.443 . . . . 0.0 107.674 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.63 57.17 0.25 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 119.805 -1.188 . . . . 0.0 113.808 -173.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.4 t -66.36 -25.97 67.05 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -96.79 24.02 6.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.373 177.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.32 -49.94 72.86 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.204 0.526 . . . . 0.0 111.321 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.509 ' HH2' HD11 ' A' ' 133' ' ' LEU . 0.6 OUTLIER -76.62 -26.88 55.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.762 -179.208 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.06 -48.73 75.1 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 120.886 0.374 . . . . 0.0 110.297 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.62 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 15.0 tt -67.33 -39.02 81.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 177.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -55.13 -46.6 75.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.457 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.5 ' HA ' HG22 ' A' ' 123' ' ' VAL . 37.5 m-20 -61.95 -41.37 97.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.471 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -59.66 -38.44 81.46 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.099 0.476 . . . . 0.0 110.399 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 70.9 mt -69.82 -47.81 61.39 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.5 HG22 ' HA ' ' A' ' 120' ' ' ASP . 24.9 m -73.28 -18.72 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.718 0.294 . . . . 0.0 111.476 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 24.7 t -71.53 0.91 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.498 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -76.87 162.85 27.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.74 0.781 . . . . 0.0 112.715 -174.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.65 8.79 1.3 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.345 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 80.9 mtt-85 -121.14 -18.26 7.5 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 122.373 0.269 . . . . 0.0 110.882 -171.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 52.9 t 57.59 71.75 0.56 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.357 0.599 . . . . 0.0 109.984 -172.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.52 130.21 39.6 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.028 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.466 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 42.7 mt-10 -81.26 114.04 19.79 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.252 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.3 t -95.53 128.08 47.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.5 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 33.8 p -133.08 145.28 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 137' ' ' MET . 60.7 mt -102.13 168.87 9.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 110.978 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.557 ' HA ' ' HE2' ' A' ' 65' ' ' PHE . 36.1 tt0 -55.13 98.77 0.02 OUTLIER 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.141 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.81 -61.35 4.05 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.587 177.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -143.33 147.11 34.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.738 0.304 . . . . 0.0 110.681 -175.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.725 ' HA ' HD12 ' A' ' 133' ' ' LEU . 83.0 mtp -76.5 110.42 11.03 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 172.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.592 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 42.8 p90 -59.63 -33.29 15.43 Favored Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -175.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 33.8 Cg_endo -66.04 -24.59 52.3 Favored 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 121.222 1.281 . . . . 0.0 112.072 174.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 82.85 -66.25 3.97 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.369 -177.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 C--O 1.235 0.319 0 C-N-CA 122.41 0.284 . . . . 0.0 110.672 -175.44 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.785 ' HB3' ' HG3' ' A' ' 4' ' ' ARG . 1.3 m-20 -101.0 151.79 21.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.993 0.425 . . . . 0.0 110.842 -176.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.502 HD11 ' HA2' ' A' ' 101' ' ' GLY . 12.8 tt -96.85 15.7 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 121.579 0.704 . . . . 0.0 109.988 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.785 ' HG3' ' HB3' ' A' ' 2' ' ' ASP . 92.8 mtt180 -57.96 -31.61 67.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.009 -176.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.45 -50.34 71.97 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.976 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.02 -47.17 86.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.993 176.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.58 ' O ' ' HB2' ' A' ' 11' ' ' MET . 13.7 m120 -52.34 -74.93 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.961 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -51.65 -66.34 0.4 Allowed 'General case' 0 C--O 1.24 0.595 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -57.34 8.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.885 -169.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -76.26 -37.76 57.15 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.111 -168.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.58 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 11.1 mmt -67.79 -40.86 83.88 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 120.156 -0.618 . . . . 0.0 109.728 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.9 -52.28 66.14 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 121.212 0.53 . . . . 0.0 110.158 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.42 -32.37 73.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.858 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.7 tp -77.38 -52.52 9.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.819 0.343 . . . . 0.0 110.801 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.407 HD21 ' CD1' ' A' ' 106' ' ' ILE . 3.5 mm? -77.05 -10.23 59.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.995 -177.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -47.98 -53.78 15.0 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.996 175.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.18 -37.73 88.53 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.254 -177.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -61.22 -42.17 98.13 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.028 0.442 . . . . 0.0 110.764 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -69.52 -41.24 76.29 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.498 ' O ' HG13 ' A' ' 24' ' ' ILE . 59.1 tttp -54.15 -50.36 67.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.093 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.2 -54.39 47.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.01 178.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.95 -41.71 64.76 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.176 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -65.93 -44.97 83.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.644 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.4 mt -61.98 -34.69 64.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 120.856 0.36 . . . . 0.0 110.39 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -69.13 -38.74 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.308 177.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.49 -21.32 66.25 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.369 0.604 . . . . 0.0 109.658 170.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.98 17.78 46.22 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.304 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -113.8 109.14 18.07 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 176.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.455 HD13 HG12 ' A' ' 24' ' ' ILE . 3.8 mm? . . . . . 0 C--N 1.329 -0.298 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 175.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 109' ' ' LEU . 1.5 tm? . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 121.378 0.609 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.474 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 8.8 ptm -147.19 113.58 5.94 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.225 174.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.574 ' HE2' HD21 ' A' ' 62' ' ' LEU . 62.5 mtt -117.42 141.29 48.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.815 -170.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.481 ' HE2' ' HG2' ' A' ' 134' ' ' GLU . 51.9 m-85 -107.03 122.08 45.75 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 168.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 t -110.62 102.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 110.933 -174.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.726 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 37.1 m -77.15 100.34 5.72 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 172.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.467 HG11 HG21 ' A' ' 80' ' ' ILE . 50.4 t -80.34 -63.64 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.153 -171.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.534 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 38.7 t -93.24 -55.39 3.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.127 0.489 . . . . 0.0 112.233 -172.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.612 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 90.86 -10.27 75.39 Favored Glycine 0 N--CA 1.451 -0.329 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 -167.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.505 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 34.6 t30 -107.79 126.61 29.46 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 176.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.567 ' O ' ' HB2' ' A' ' 102' ' ' SER . 19.0 Cg_endo -56.62 -16.45 19.12 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.6 2.867 . . . . 0.0 114.42 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.681 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.1 m -61.66 95.61 0.05 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.291 0.567 . . . . 0.0 110.468 -177.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -44.94 -31.01 1.12 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.571 1.148 . . . . 0.0 113.918 -172.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.681 ' HG3' HG22 ' A' ' 73' ' ' THR . 0.0 OUTLIER -51.76 -34.61 40.2 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -175.598 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.612 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 5.6 mm-40 -58.23 -55.66 32.17 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.02 0.438 . . . . 0.0 111.023 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.6 m -65.21 -34.73 79.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.923 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.62 -51.65 68.48 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.722 0.296 . . . . 0.0 110.341 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 50.3 mt-10 -55.79 -54.11 48.47 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.33 0.586 . . . . 0.0 110.079 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.488 HD12 HD12 ' A' ' 83' ' ' LEU . 2.6 tp -62.15 -42.36 94.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.146 -172.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 72.6 m -64.67 -39.2 93.27 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.629 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.2 m -62.66 -40.28 96.56 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 120.838 0.351 . . . . 0.0 110.339 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.488 HD12 HD12 ' A' ' 80' ' ' ILE . 86.6 mt -60.89 -50.09 74.81 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 53.9 m0 -60.61 -31.7 70.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.036 -178.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.582 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 35.3 tt0 -62.75 -63.36 1.24 Allowed 'General case' 0 C--O 1.235 0.327 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 173.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.49 -13.68 24.22 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.634 -0.712 . . . . 0.0 114.025 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -96.55 -71.36 0.68 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.376 0.588 . . . . 0.0 111.743 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 9.4 mp -56.42 -54.96 39.48 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.342 -174.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.582 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 91.8 m-85 -72.02 -14.32 61.85 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.358 -173.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -78.62 -32.7 47.58 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.46 11.74 22.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.672 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 72.65 25.7 2.56 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.359 0.664 . . . . 0.0 112.638 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 27.7 m-85 -81.99 81.77 7.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.445 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.64 82.49 3.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.239 0.542 . . . . 0.0 109.922 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.839 HG12 HD21 ' A' ' 109' ' ' LEU . 4.3 m -109.14 165.56 5.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.365 -177.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -101.5 136.54 41.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 174.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.623 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.33 142.22 23.83 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -172.805 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -127.27 127.74 44.86 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.6 tt -87.4 88.0 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 122.071 0.939 . . . . 0.0 109.125 173.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.78 134.58 38.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.119 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.502 ' HA2' HD11 ' A' ' 3' ' ' ILE . . . 100.4 104.7 2.67 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.567 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 11.1 p -38.23 -51.92 1.47 Allowed 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -173.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.612 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 10.1 p-10 -102.11 8.16 40.83 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.726 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 54.4 mtt180 -137.04 140.8 42.31 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.58 143.85 46.5 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.641 173.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.645 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.7 tt -112.34 139.56 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.741 0.305 . . . . 0.0 111.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -128.77 139.85 52.0 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.781 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.645 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.3 mpp? -135.14 143.19 46.4 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.049 0.452 . . . . 0.0 110.517 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.839 HD21 HG12 ' A' ' 95' ' ' VAL . 12.4 mt -138.44 151.98 47.92 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.366 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 110' ' ' ARG . 7.3 mmm180 -85.35 -33.02 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.589 176.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -112.73 152.9 28.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.163 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -118.34 27.39 7.33 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 121.273 -0.489 . . . . 0.0 112.474 -178.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -66.02 -69.25 0.31 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.019 0.438 . . . . 0.0 110.693 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.02 25.71 1.1 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.329 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.76 92.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.824 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -77.52 -31.29 53.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.362 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -67.45 -50.84 57.44 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.215 177.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 7.6 tt -62.72 -37.9 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.344 -0.389 . . . . 0.0 109.985 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.478 ' HD3' ' N ' ' A' ' 120' ' ' ASP . 12.2 tmtt? -56.48 -51.64 67.69 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.293 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.482 ' HA ' HG22 ' A' ' 123' ' ' VAL . 64.9 m-20 -62.15 -33.37 74.37 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.668 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -67.58 -42.79 81.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 94.5 mt -61.08 -41.65 97.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.482 HG22 ' HA ' ' A' ' 120' ' ' ASP . 20.6 m -79.06 -15.91 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.515 0.197 . . . . 0.0 111.246 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.5 t -64.87 2.17 0.76 Allowed 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.539 ' HB2' ' HB2' ' A' ' 129' ' ' ALA . 1.2 mp0 -84.87 98.84 10.55 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.349 0.595 . . . . 0.0 110.174 -176.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -45.97 -51.24 13.73 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.467 -1.242 . . . . 0.0 113.582 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 30.9 mtm180 -55.79 -44.65 77.97 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.71 0.29 . . . . 0.0 111.482 -174.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 69' ' ' SER . 21.5 p 177.07 136.0 0.06 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.779 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 125' ' ' GLN . . . -170.93 116.98 0.46 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.75 0.309 . . . . 0.0 111.171 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -137.03 127.61 26.89 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 10.8 p -123.9 143.97 35.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 0.0 110.773 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 53.6 m -131.53 144.98 51.52 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 177.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.449 HD23 ' HG2' ' A' ' 64' ' ' MET . 64.1 mt -93.58 145.5 24.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.481 ' HG2' ' HE2' ' A' ' 65' ' ' PHE . 0.2 OUTLIER -82.19 140.11 33.91 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.23 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.09 -108.14 3.53 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 -176.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -148.32 173.02 13.48 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.536 0.334 . . . . 0.0 110.361 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 14.0 tpt -72.61 106.0 4.47 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.517 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 90.4 m-85 -71.72 -52.46 8.12 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.517 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 92.2 Cg_endo -80.56 124.1 5.08 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 121.872 1.714 . . . . 0.0 111.938 -178.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 90.23 102.4 1.16 Allowed Glycine 0 N--CA 1.451 -0.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.419 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.235 0.294 0 CA-C-O 120.826 0.346 . . . . 0.0 110.601 -179.922 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.94 0 N-CA-C 111.888 -0.485 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -141.61 -39.14 0.39 Allowed 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.985 0.421 . . . . 0.0 110.664 -175.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.626 HG21 ' HB3' ' A' ' 103' ' ' ASP . 12.1 tt -67.97 92.35 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.61 0.719 . . . . 0.0 110.657 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 60.7 mtt85 -109.58 -37.13 5.78 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.499 -175.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -56.31 -43.58 79.06 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.736 -178.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.448 ' HE1' HG13 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -55.21 -47.11 75.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.441 176.731 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.606 ' O ' ' HB2' ' A' ' 11' ' ' MET . 44.1 m-80 -60.88 -64.54 0.92 Allowed 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -50.36 -69.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.683 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.45 ' HB1' ' NH1' ' A' ' 13' ' ' ARG . . . -59.38 -64.4 0.96 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.042 -174.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.73 -46.49 65.81 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.863 -167.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.606 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 22.3 mmt -70.54 -38.51 74.22 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.938 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.32 -47.12 77.66 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.417 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.45 ' NH1' ' HB1' ' A' ' 9' ' ' ALA . 80.3 mtt180 -70.3 -26.79 63.95 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.885 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.6 tp -82.77 -52.28 6.9 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.907 176.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 4.1 mm? -73.1 -17.25 61.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.986 -174.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.5 OUTLIER -57.47 -32.97 67.5 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.102 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.96 -45.76 84.39 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.806 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -63.29 -41.21 98.96 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.912 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 46.5 mt-10 -63.02 -43.13 99.59 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.394 0.616 . . . . 0.0 109.381 176.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 24' ' ' ILE . 26.4 ttpt -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.12 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -59.07 -44.93 91.92 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.319 0.58 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.5 -37.24 86.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.32 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.33 -37.53 80.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.945 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 20' ' ' LYS . 85.8 mt -62.17 -38.53 81.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 174.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.87 -36.34 82.97 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.898 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -63.02 -15.07 55.17 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.738 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.99 24.77 26.4 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.682 177.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -134.7 132.0 38.33 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.406 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.5 mm? . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.574 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 C--O 1.235 0.302 0 CA-C-O 121.208 0.528 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 21.4 ptm -132.03 110.23 10.58 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.675 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 56.8 mtt -114.73 122.15 45.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.721 -169.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -88.38 117.83 27.57 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 168.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.532 HG21 HD13 ' A' ' 122' ' ' LEU . 39.5 t -114.43 104.75 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.588 0.232 . . . . 0.0 110.954 -173.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.732 HG23 ' HB2' ' A' ' 130' ' ' GLU . 1.6 t -84.96 122.37 29.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -85.35 -61.58 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.302 -174.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 30.9 t -92.88 -36.38 12.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.145 0.498 . . . . 0.0 111.127 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.94 7.52 77.61 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -168.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.406 ' ND2' ' HD2' ' A' ' 72' ' ' PRO . 26.0 t-20 -126.63 139.98 36.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 114.66 -0.77 . . . . 0.0 109.802 -176.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.406 ' HD2' ' ND2' ' A' ' 71' ' ' ASN . 7.4 Cg_endo -47.51 -16.23 0.41 Allowed 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.632 3.555 . . . . 0.0 116.586 -174.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.5 p -76.73 160.28 29.46 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.501 1.046 . . . . 0.0 110.869 -169.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.605 ' HG2' ' HG3' ' A' ' 78' ' ' GLU . 37.5 tt0 -104.08 -25.38 12.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.646 -166.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.754 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.58 -52.74 53.75 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.678 -171.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -45.37 -58.89 2.99 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.283 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.473 ' HA ' HG22 ' A' ' 80' ' ' ILE . 35.5 m -67.13 -35.97 80.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.856 -174.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.605 ' HG3' ' HG2' ' A' ' 74' ' ' GLU . 49.1 mt-10 -56.05 -60.17 3.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.09 176.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.431 ' O ' HD13 ' A' ' 83' ' ' LEU . 44.0 mt-10 -59.08 -54.02 51.82 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.899 -175.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.823 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.9 tp -62.36 -42.76 96.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.938 -174.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 91.7 m -64.0 -33.18 75.15 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.457 0.17 . . . . 0.0 111.063 176.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.1 m -63.04 -39.07 93.65 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 110.294 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 79' ' ' GLU . 10.4 mp -67.75 -48.28 66.86 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.539 174.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 43.7 m0 -55.87 -55.94 26.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.968 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -57.33 -54.81 42.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.61 -29.16 3.93 Favored Glycine 0 C--N 1.333 0.393 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.273 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.6 m -91.79 -57.1 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 117.527 0.664 . . . . 0.0 111.284 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.88 -48.62 79.3 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.667 -174.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -74.31 -22.49 59.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.979 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -73.62 -29.41 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.15 0.5 51.51 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.128 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 66.43 36.59 5.06 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.193 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -81.47 119.75 24.13 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -84.75 49.94 1.81 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.245 0.545 . . . . 0.0 111.199 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.99 150.21 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.433 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -102.49 144.98 30.23 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.489 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -146.42 137.92 24.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.147 -177.117 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -127.45 123.14 35.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 175.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -93.74 88.12 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.997 0.903 . . . . 0.0 109.337 173.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.448 HG13 ' HE1' ' A' ' 6' ' ' TYR . 7.0 p -131.53 143.39 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.093 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.2 85.74 0.14 Allowed Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.9 m -30.21 -44.27 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -167.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.626 ' HB3' HG21 ' A' ' 3' ' ' ILE . 13.2 t70 -69.18 -32.81 72.38 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -172.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 93.0 mtt180 -122.46 134.17 54.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.296 0.57 . . . . 0.0 112.323 -171.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -102.65 132.68 48.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 170.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.532 HD12 ' SD ' ' A' ' 11' ' ' MET . 9.3 tt -104.65 129.68 56.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.041 0.448 . . . . 0.0 111.197 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -115.2 132.38 56.63 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.613 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -131.27 136.52 48.25 Favored 'General case' 0 C--O 1.244 0.798 0 CA-C-O 121.366 0.603 . . . . 0.0 110.993 177.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.491 HD21 HD12 ' A' ' 118' ' ' ILE . 4.6 mp -123.11 156.13 35.59 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.871 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -105.09 5.72 32.65 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -135.35 151.75 50.8 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.493 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -127.58 41.53 1.58 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.054 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.8 m -93.6 -65.53 0.99 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.055 0.455 . . . . 0.0 110.113 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 41.4 p90 -91.0 27.6 1.79 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.021 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.61 -48.1 73.4 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.74 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -30.88 69.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.202 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.426 ' HB3' ' O ' ' A' ' 114' ' ' TYR . 5.1 tp10 -52.91 -49.71 65.39 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 172.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.619 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 25.1 mt -64.46 -45.41 95.86 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.126 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -58.17 7.32 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.317 0.58 . . . . 0.0 110.072 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.508 ' O ' ' HB2' ' A' ' 124' ' ' SER . 11.2 m-20 -61.38 -36.85 81.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.791 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -63.36 -47.16 83.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.738 0.304 . . . . 0.0 110.381 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.5 mt -57.81 -45.9 85.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.815 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.525 HG12 ' O ' ' A' ' 129' ' ' ALA . 13.1 m -84.97 -6.75 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -177.091 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 23.2 t -68.65 0.99 3.54 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.823 ' HG2' HD11 ' A' ' 80' ' ' ILE . 3.2 mp0 -96.04 155.7 16.65 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.602 -0.686 . . . . 0.0 110.633 -174.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -51.59 -51.68 53.56 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.873 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -67.18 -10.12 47.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.483 179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 63.4 m 66.08 -156.62 0.26 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.906 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.525 ' O ' HG12 ' A' ' 123' ' ' VAL . . . 173.23 126.77 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.732 ' HB2' HG23 ' A' ' 67' ' ' THR . 46.0 mt-10 -96.97 113.66 25.21 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.339 0.59 . . . . 0.0 110.331 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.9 t -98.99 135.94 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.282 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.4 m -127.1 112.75 15.54 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.675 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.6 mp -89.95 128.03 36.15 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -95.32 103.99 15.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.866 0.365 . . . . 0.0 110.109 176.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 155.9 -150.29 21.6 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.769 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -88.47 123.23 32.79 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.963 0.411 . . . . 0.0 110.376 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.502 ' HG3' ' HD2' ' A' ' 139' ' ' PRO . 0.1 OUTLIER -76.6 94.43 3.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.737 178.168 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.498 ' CG ' ' HD3' ' A' ' 139' ' ' PRO . 23.9 p90 -70.13 -30.91 2.1 Favored Pre-proline 0 CA--C 1.544 0.732 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.502 ' HD2' ' HG3' ' A' ' 137' ' ' MET . 21.2 Cg_exo -67.61 78.99 0.49 Allowed 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 121.582 1.522 . . . . 0.0 111.363 172.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 157.17 -172.11 34.61 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.858 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 95.7 mttt . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.82 0.343 . . . . 0.0 110.663 -179.139 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -110.08 153.7 24.29 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.852 0.358 . . . . 0.0 110.614 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.4 tt -111.5 0.37 9.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 173.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -52.25 -36.41 52.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.304 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.6 -49.9 75.8 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.008 0.433 . . . . 0.0 110.4 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.4 -48.09 76.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.662 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.08 -62.01 1.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.635 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -57.71 -56.91 15.77 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.281 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.93 -61.48 2.58 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.586 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.91 -54.87 41.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.162 -174.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.471 ' O ' HD23 ' A' ' 15' ' ' LEU . 6.2 mmt -58.01 -52.39 65.72 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-O 120.599 0.238 . . . . 0.0 110.904 -176.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.55 -50.18 74.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.019 0.438 . . . . 0.0 111.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -77.41 -12.11 59.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.142 -0.481 . . . . 0.0 112.095 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.2 tp -79.96 -52.15 8.2 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.387 0.613 . . . . 0.0 109.572 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.7 -15.31 62.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.72 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.49 -43.41 45.26 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.572 0.701 . . . . 0.0 109.724 171.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -61.76 -45.65 93.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.454 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.449 ' CZ3' ' HG3' ' A' ' 108' ' ' MET . 28.4 m95 -62.26 -37.43 85.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -60.49 -43.5 96.94 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.053 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.9 tttt -61.43 -50.76 71.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.458 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.11 -46.71 79.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.792 0.329 . . . . 0.0 111.469 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -57.44 -48.69 78.48 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.369 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 28.9 t70 -71.62 -28.88 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 20' ' ' LYS . 50.4 mt -64.42 -42.51 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -69.98 -26.95 64.33 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.03 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.423 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 8.4 tp10 -60.44 -18.32 50.3 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.642 0.734 . . . . 0.0 109.264 169.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.14 35.26 6.38 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.84 172.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -156.48 141.84 17.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' N ' HD12 ' A' ' 29' ' ' LEU . 7.0 mp . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.492 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 109' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 121.238 0.542 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.764 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 28.9 mtp -138.74 132.17 30.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.723 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 63.4 mtt -116.88 125.21 51.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.225 0.536 . . . . 0.0 112.147 -170.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.581 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 72.2 m-85 -95.17 121.63 37.01 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 168.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.511 HG21 HD13 ' A' ' 122' ' ' LEU . 40.6 t -117.02 105.59 18.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.755 0.312 . . . . 0.0 110.614 -174.136 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.2 m -79.37 98.42 6.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.496 HG11 HG21 ' A' ' 80' ' ' ILE . 25.2 t -79.64 -60.33 2.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.727 -172.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' A' ' 71' ' ' ASN . 39.9 t -92.62 -57.03 2.8 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.015 -173.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.735 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 82.12 11.52 82.29 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 -167.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.482 ' ND2' ' HD2' ' A' ' 72' ' ' PRO . 26.0 t-20 -125.99 136.07 27.96 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 123.15 0.58 . . . . 0.0 109.709 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.482 ' HD2' ' ND2' ' A' ' 71' ' ' ASN . 30.3 Cg_endo -59.99 -16.89 41.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.886 3.057 . . . . 0.0 116.382 -168.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.7 p -69.65 172.18 7.85 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.27 0.941 . . . . 0.0 112.144 -173.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.91 -22.62 14.29 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.41 -167.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.607 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 10.8 mptt -60.65 -51.89 67.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.601 -170.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.522 ' HG2' ' H ' ' A' ' 77' ' ' THR . 1.6 pm0 -47.57 -62.58 1.37 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.721 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.522 ' H ' ' HG2' ' A' ' 76' ' ' GLU . 14.2 t -60.96 -43.9 98.06 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.48 0.181 . . . . 0.0 110.904 -174.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -57.4 -60.87 3.0 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.165 0.507 . . . . 0.0 110.881 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 37.6 mt-10 -67.73 -37.85 82.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.701 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.496 HG21 HG11 ' A' ' 68' ' ' VAL . 9.8 tp -70.09 -39.76 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.444 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.5 m -64.87 -38.03 89.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.608 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.4 p -67.47 -34.86 78.03 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.701 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 92.5 mt -64.6 -48.85 73.38 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.965 0.412 . . . . 0.0 110.074 174.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 m0 -58.18 -39.9 80.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.803 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -57.15 -58.82 6.54 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.57 -28.07 36.15 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 115.439 -0.8 . . . . 0.0 113.804 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.7 m -85.15 -69.3 0.66 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 117.395 0.597 . . . . 0.0 111.805 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.5 mp -59.95 -35.09 74.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -172.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -85.67 -2.58 58.33 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -103.85 -26.27 12.75 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 171.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.85 -11.25 59.94 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.308 0.575 . . . . 0.0 109.461 168.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 66.56 78.74 0.25 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.647 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -117.13 170.65 8.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.667 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -125.86 98.22 5.44 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.426 HG12 ' CD2' ' A' ' 109' ' ' LEU . 30.9 m -139.02 153.7 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.756 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.446 ' HB3' ' SD ' ' A' ' 108' ' ' MET . 6.6 tp60 -101.56 145.57 28.85 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 169.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.64 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -148.79 132.84 17.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.618 -169.771 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -129.96 132.88 46.47 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.141 175.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.495 HD11 HG23 ' A' ' 77' ' ' THR . 8.6 tt -91.31 89.03 2.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.704 0.764 . . . . 0.0 109.677 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.4 125.62 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.056 -178.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 101.0 104.6 2.72 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -167.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.446 ' O ' ' HB ' ' A' ' 77' ' ' THR . 16.0 m -47.93 -34.03 8.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.575 0.584 . . . . 0.0 112.575 -175.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.735 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 7.1 p-10 -103.22 -4.19 24.69 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -135.67 136.34 40.85 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.919 0.39 . . . . 0.0 111.789 -164.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.2 154.68 30.71 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.003 175.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.7 tt -123.41 139.05 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.412 178.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -131.41 154.32 48.77 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.114 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 18' ' ' TRP . 0.8 OUTLIER -148.38 135.32 20.07 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.357 0.599 . . . . 0.0 111.821 176.265 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.426 ' CD2' HG12 ' A' ' 95' ' ' VAL . 13.2 mt -108.93 109.33 20.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.589 174.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.72 -27.06 31.42 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 175.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -147.38 111.61 5.18 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.925 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.52 129.32 1.34 Allowed Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.756 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.3 m -95.25 -19.75 19.76 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 111.043 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -75.64 35.9 0.13 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.962 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.0 -56.44 21.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.877 -177.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.426 ' HA ' ' HB3' ' A' ' 119' ' ' LYS . 0.7 OUTLIER -73.96 -14.42 61.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.522 -176.684 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -75.55 -52.47 10.55 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.9 tt -62.38 -39.35 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.723 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 51.9 tttm -54.71 -51.67 64.86 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.511 174.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.49 -43.86 76.0 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.561 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -66.74 -39.76 88.06 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 98.7 mt -65.5 -39.97 92.5 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.046 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 30.0 m -89.41 -2.66 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 120.821 0.343 . . . . 0.0 111.081 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.2 t -61.99 2.16 0.24 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -87.3 104.25 16.23 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.429 0.633 . . . . 0.0 110.347 -174.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -48.31 -44.81 34.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.328 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -69.23 -44.82 71.23 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.449 ' O ' ' HB3' ' A' ' 129' ' ' ALA . 23.5 t -166.75 -152.95 0.14 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.631 -171.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 128' ' ' CYS . . . 84.25 109.23 0.06 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.048 0.939 . . . . 0.0 111.921 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -124.28 141.43 52.07 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.422 175.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 14.8 p -118.83 149.71 21.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.023 0.44 . . . . 0.0 111.474 -174.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.3 m -143.18 146.83 34.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 137' ' ' MET . 86.4 mt -86.85 162.32 17.83 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.838 0.352 . . . . 0.0 111.222 -175.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.764 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 1.6 tm-20 -67.02 130.4 43.01 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.893 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.97 -77.29 1.82 Allowed Glycine 0 N--CA 1.449 -0.481 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.026 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -151.46 146.38 25.88 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 122.732 0.413 . . . . 0.0 110.272 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.501 ' HA ' HD12 ' A' ' 133' ' ' LEU . 69.9 mtp -78.21 112.79 15.54 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 171.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -55.34 -48.95 95.08 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.334 -174.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.409 ' HG3' ' CZ2' ' A' ' 116' ' ' TRP . 72.6 Cg_endo -77.08 -1.72 11.91 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 121.78 1.653 . . . . 0.0 112.595 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 93.27 163.42 36.93 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 -174.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 117.01 0.405 . . . . 0.0 110.186 178.693 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 112.431 -0.267 . . . . 0.0 112.431 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 58.8 23.38 11.17 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.258 0.551 . . . . 0.0 110.619 -177.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 50.6 mm -65.38 -43.46 94.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.632 -178.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.3 mtm105 -61.15 -50.16 74.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.506 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.98 -49.76 74.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.336 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -58.78 -46.92 86.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.15 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.419 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.2 m-80 -53.19 -71.56 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.173 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -53.6 -61.86 2.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.197 -176.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.405 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.4 -63.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.663 -172.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.58 -43.53 89.46 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.795 -170.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.419 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 35.3 mtp -72.88 -32.5 65.43 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.055 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.32 88.99 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 172.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 94.7 mtt180 -69.23 -18.85 63.93 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.881 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 66.2 tp -79.52 -52.84 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 110.168 175.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 15' ' ' LEU . 3.9 mm? -71.95 -9.37 58.26 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.781 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -48.25 -40.48 24.76 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.64 0.733 . . . . 0.0 109.159 168.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 51.2 tp60 -61.49 -50.06 74.25 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.442 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.433 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 13.8 m95 -59.73 -35.13 73.93 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.485 -177.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -60.95 -46.19 91.71 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -59.08 -44.17 91.88 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.976 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -59.32 -55.09 39.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.718 0.294 . . . . 0.0 110.632 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.2 -37.72 78.13 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.92 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.08 -50.43 73.3 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.59 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.513 HG12 HD13 ' A' ' 29' ' ' LEU . 77.2 mt -58.57 -39.46 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-O 121.134 0.493 . . . . 0.0 110.248 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.7 -35.15 79.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -78.41 -1.21 32.43 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.13 27.46 37.02 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.38 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -126.75 109.94 12.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.617 0.246 . . . . 0.0 110.392 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.513 HD13 HG12 ' A' ' 24' ' ' ILE . 3.5 mm? . . . . . 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.7 tt . . . . . 0 C--O 1.238 0.474 0 CA-C-O 121.841 0.829 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.424 ' HG2' ' HA ' ' A' ' 108' ' ' MET . 67.4 mtp -141.02 144.33 34.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.631 172.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.2 mtt -118.42 122.43 42.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.86 0.362 . . . . 0.0 111.385 -176.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.522 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 52.2 m-85 -98.47 95.38 7.28 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.9 t -87.83 146.43 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 122.244 -0.285 . . . . 0.0 110.327 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.476 ' HB ' ' NH2' ' A' ' 104' ' ' ARG . 7.2 t -125.26 110.37 13.96 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 174.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.527 HG11 HG21 ' A' ' 80' ' ' ILE . 21.4 t -98.44 -60.94 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.355 -169.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -83.34 -50.08 8.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.862 -170.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.8 20.34 74.2 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -168.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -126.35 136.97 29.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 114.743 -0.729 . . . . 0.0 109.125 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -64.05 -15.79 51.26 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.32 2.68 . . . . 0.0 114.693 -172.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.615 HG22 ' HD3' ' A' ' 75' ' ' LYS . 17.1 m -75.76 119.97 20.5 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.555 0.693 . . . . 0.0 111.26 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -55.58 -23.62 28.18 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.528 0.731 . . . . 0.0 111.557 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.615 ' HD3' HG22 ' A' ' 73' ' ' THR . 11.0 mptt -62.2 -62.83 1.49 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.705 -169.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.452 ' OE1' ' HB ' ' A' ' 73' ' ' THR . 13.8 pm0 -65.95 -37.15 85.27 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.543 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.509 HG23 HD11 ' A' ' 99' ' ' ILE . 12.2 t -68.3 -38.79 82.0 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.638 0.256 . . . . 0.0 110.312 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.83 -46.62 89.84 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 45.7 mt-10 -56.18 -54.24 47.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.134 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.608 HD12 HD12 ' A' ' 83' ' ' LEU . 11.1 tp -63.19 -43.14 98.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-O 120.946 0.403 . . . . 0.0 111.006 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.8 m -66.69 -30.7 71.02 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.065 0.46 . . . . 0.0 110.21 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.7 t -70.68 -33.9 71.4 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.699 177.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.608 HD12 HD12 ' A' ' 80' ' ' ILE . 88.0 mt -63.52 -45.16 91.91 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.254 0.549 . . . . 0.0 109.705 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 53.1 m0 -60.85 -44.66 96.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.948 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -57.84 -38.64 76.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.234 0.54 . . . . 0.0 109.982 172.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.18 -31.35 77.28 Favored Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.737 -178.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.4 m -95.99 -60.36 1.65 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.77 -48.05 80.77 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.402 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 64.7 m-85 -69.95 -32.7 71.08 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.739 0.304 . . . . 0.0 110.892 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -67.66 -28.22 67.52 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.237 0.541 . . . . 0.0 109.705 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.85 8.73 11.6 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.366 175.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 68.13 30.17 5.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.094 174.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -89.45 108.36 19.6 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 173.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -80.47 62.74 4.68 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.328 0.585 . . . . 0.0 110.623 178.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.5 m -90.45 167.75 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.113 176.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.749 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.8 tp60 -110.17 143.13 40.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.447 173.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.461 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.86 135.13 35.89 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.726 0.298 . . . . 0.0 110.539 -177.831 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -131.02 153.45 49.24 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.509 HD11 HG23 ' A' ' 77' ' ' THR . 9.4 tt -130.71 90.04 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.68 0.752 . . . . 0.0 110.745 -179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.2 p -130.57 128.24 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.9 104.01 2.67 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -167.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -46.68 -25.63 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 67' ' ' THR . 12.1 p-10 -100.67 -27.73 13.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.319 0.58 . . . . 0.0 110.209 178.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.476 ' NH2' ' HB ' ' A' ' 67' ' ' THR . 0.2 OUTLIER -84.62 121.57 27.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.764 -171.322 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -116.42 132.42 56.68 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 13.0 tt -124.38 132.25 71.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-O 121.083 0.468 . . . . 0.0 111.44 -173.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -120.74 128.75 53.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.355 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.749 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 1.8 mpt? -99.16 122.33 42.22 Favored 'General case' 0 C--O 1.247 0.971 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.347 177.396 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.454 ' N ' HD22 ' A' ' 109' ' ' LEU . 2.4 mm? -117.64 121.66 41.48 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 123.839 0.712 . . . . 0.0 109.264 174.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.7 mmm-85 -67.89 -49.11 63.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -128.27 110.99 12.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.769 172.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -89.86 47.01 3.15 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.616 -175.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.2 m -59.56 -39.69 84.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.269 0.557 . . . . 0.0 110.481 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 22.0 p90 -98.34 23.32 8.53 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.154 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.54 97.39 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.509 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -67.71 -34.05 76.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.353 -176.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -59.55 -43.58 93.5 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.102 0.477 . . . . 0.0 109.91 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.559 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -65.39 -42.22 93.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.481 176.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -53.72 -52.06 61.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.225 0.536 . . . . 0.0 110.182 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.447 ' HA ' HG22 ' A' ' 123' ' ' VAL . 1.7 m-20 -62.04 -38.1 87.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.635 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -61.86 -53.68 52.55 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.722 0.296 . . . . 0.0 110.464 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 76.0 mt -50.65 -47.69 58.49 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.419 177.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.447 HG22 ' HA ' ' A' ' 120' ' ' ASP . 19.8 m -80.22 -13.34 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.583 0.23 . . . . 0.0 111.412 -177.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.1 t -73.9 -0.78 17.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.957 0.408 . . . . 0.0 110.558 175.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.485 HE22 HD11 ' A' ' 80' ' ' ILE . 15.3 mt-30 -84.13 165.24 18.63 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -78.79 -47.1 17.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.776 -167.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -86.89 -20.68 27.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.094 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 57.6 m 67.37 175.36 0.26 Allowed 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.433 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -161.24 156.46 24.18 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.96 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -99.74 157.1 16.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.246 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.69 151.66 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.139 0.495 . . . . 0.0 111.221 -174.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.522 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 59.8 m -124.87 134.49 52.68 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.646 HD12 ' SD ' ' A' ' 137' ' ' MET . 88.9 mt -96.5 142.75 28.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.329 -175.168 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -84.09 132.67 34.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.963 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.59 -86.94 1.14 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.174 -0.467 . . . . 0.0 112.219 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -141.43 151.47 43.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.684 0.278 . . . . 0.0 110.422 -176.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.646 ' SD ' HD12 ' A' ' 133' ' ' LEU . 15.1 tpt -72.41 94.67 1.67 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 175.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.504 ' CD2' HD13 ' A' ' 133' ' ' LEU . 11.4 m-85 -53.65 -50.87 81.02 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.29 -175.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 5.8 Cg_exo -81.51 31.92 0.52 Allowed 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 122.809 2.34 . . . . 0.0 112.549 179.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -163.15 68.79 0.22 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.005 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 95.5 mttt . . . . . 0 C--O 1.238 0.499 0 CA-C-O 120.882 0.372 . . . . 0.0 111.058 -177.587 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.875 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 t70 69.03 116.33 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.176 0.59 . . . . 0.0 112.427 177.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.2 tt -130.47 13.04 2.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 122.246 1.022 . . . . 0.0 108.408 171.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 18.4 ttp180 -63.06 -37.28 86.57 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.382 -1.281 . . . . 0.0 111.651 -175.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 1.1 m-20 -58.19 -46.62 85.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.19 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.554 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.9 OUTLIER -54.32 -47.67 72.23 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 173.342 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.512 ' O ' ' HB2' ' A' ' 11' ' ' MET . 4.2 m-20 -50.63 -76.18 0.02 OUTLIER 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.735 -177.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -61.3 -61.94 2.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.14 -176.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 5' ' ' ASP . . . -62.44 -50.64 70.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.949 -169.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.554 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 1.3 m-20 -78.48 -43.57 26.74 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.523 -172.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.528 ' O ' HD23 ' A' ' 15' ' ' LEU . 8.9 mmt -63.12 -43.05 99.49 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.833 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 16' ' ' GLU . . . -64.51 -53.91 40.72 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.902 0.382 . . . . 0.0 110.327 177.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.1 ttp-105 -52.33 -38.75 59.42 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.946 -175.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.6 tp -84.88 -49.16 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.334 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 11' ' ' MET . 4.5 mm? -68.11 -21.43 64.95 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -172.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 29.8 mt-10 -55.64 -25.71 40.58 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.914 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 46.4 tt0 -63.08 -49.74 73.31 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 176.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -64.31 -35.29 80.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.161 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.98 -53.19 61.01 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.517 ' O ' HG13 ' A' ' 24' ' ' ILE . 20.1 ttpp -51.67 -43.11 62.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.791 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -62.21 -52.79 62.36 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.546 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -69.55 -28.24 65.83 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.4 -177.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -65.16 -45.78 83.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.1 0.476 . . . . 0.0 110.397 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 20' ' ' LYS . 68.6 mt -60.75 -43.91 96.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.341 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -66.14 -36.25 82.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -63.75 -26.25 68.56 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.413 0.625 . . . . 0.0 109.763 175.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.97 40.84 4.5 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.518 176.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -147.04 110.3 4.82 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 173.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.236 0.363 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.527 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.402 HD22 HD23 ' A' ' 133' ' ' LEU . 2.5 pp . . . . . 0 C--O 1.243 0.753 0 CA-C-O 122.402 1.096 . . . . 0.0 113.553 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 23.8 ptp -125.69 132.61 52.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 113.709 -1.587 . . . . 0.0 107.99 174.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.457 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 82.8 mtp -108.29 116.91 32.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 -174.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.441 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 56.5 m-85 -89.16 125.51 35.08 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.525 HG11 HD22 ' A' ' 122' ' ' LEU . 22.1 t -115.83 98.3 6.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.756 ' HB ' ' HB3' ' A' ' 130' ' ' GLU . 4.9 m -74.41 94.92 2.63 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 176.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 p -102.11 -47.1 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.096 -169.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 m -91.26 -49.23 6.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.883 0.373 . . . . 0.0 111.569 -172.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 66.99 10.96 57.56 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -170.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 33.2 t30 -127.2 125.72 24.11 Favored Pre-proline 0 CA--C 1.533 0.306 0 C-N-CA 123.229 0.612 . . . . 0.0 109.565 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 25.4 Cg_exo -61.94 -18.3 60.48 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.282 2.655 . . . . 0.0 113.503 -177.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.445 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 37.7 m -55.44 104.15 0.12 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.699 0.4 . . . . 0.0 111.073 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.498 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 42.1 mt-10 -50.05 -25.93 3.88 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.579 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 0.3 OUTLIER -58.49 -37.61 75.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.809 -177.113 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -57.74 -64.79 0.78 Allowed 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.639 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.464 ' HA ' HG22 ' A' ' 80' ' ' ILE . 12.6 t -62.3 -36.13 81.17 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.648 -177.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -53.47 -59.7 4.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.988 0.423 . . . . 0.0 110.922 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.78 -45.74 74.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.373 -175.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.464 HG22 ' HA ' ' A' ' 77' ' ' THR . 10.8 tp -66.92 -42.02 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.164 -175.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 67.8 m -69.86 -33.15 71.87 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.638 0.256 . . . . 0.0 110.447 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.6 t -59.33 -47.53 85.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.114 0.483 . . . . 0.0 109.719 175.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.8 mt -59.78 -48.19 82.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.053 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.433 ' CD1' ' HE2' ' A' ' 121' ' ' PHE . 44.1 m0 -58.69 -32.74 69.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.032 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.626 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 29.6 tt0 -66.1 -62.77 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -57.69 -18.12 30.19 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.791 -0.64 . . . . 0.0 114.143 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.3 m -95.88 -65.28 0.98 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 117.498 0.649 . . . . 0.0 111.574 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.33 -52.31 54.76 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.83 0.348 . . . . 0.0 111.34 -173.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.626 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 98.1 m-85 -72.27 -9.13 58.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 0.0 111.156 -176.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 39.2 t30 -72.81 -26.81 61.64 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.51 14.32 17.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.759 177.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 60.11 77.35 0.32 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.037 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -107.33 119.14 38.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.548 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -78.09 69.35 4.29 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.691 0.757 . . . . 0.0 109.768 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.533 HG22 HD13 ' A' ' 109' ' ' LEU . 57.7 t -126.02 136.79 59.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.586 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -101.6 115.46 30.57 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.597 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -107.49 131.93 53.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.243 -175.21 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.529 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.5 m-30 -110.55 131.09 55.35 Favored 'General case' 0 C--O 1.247 0.962 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.4 tt -111.38 89.69 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.991 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.44 144.39 17.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.68 82.51 0.23 Allowed Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.966 -1.254 . . . . 0.0 109.966 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.498 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 12.6 m -50.13 -23.6 2.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -168.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -61.0 -25.07 66.62 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.678 0.275 . . . . 0.0 110.828 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -145.49 159.62 42.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.612 0.72 . . . . 0.0 112.398 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -122.64 139.54 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.857 -1.065 . . . . 0.0 108.326 168.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.529 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 5.1 tt -110.12 126.3 67.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.588 -177.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.464 ' HB3' HG11 ' A' ' 95' ' ' VAL . 96.8 m-85 -112.25 112.1 23.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.185 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.506 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 68.5 mtm -90.93 122.43 33.61 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.533 HD13 HG22 ' A' ' 95' ' ' VAL . 4.0 mm? -87.61 103.92 16.02 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 123.513 0.508 . . . . 0.0 110.718 -175.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.6 -28.95 56.34 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 172.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -135.2 116.27 14.27 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.677 -1.147 . . . . 0.0 108.644 172.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -103.92 16.52 50.56 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.223 -0.513 . . . . 0.0 114.038 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -60.5 -20.39 59.98 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 117.207 0.504 . . . . 0.0 111.373 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -120.0 24.73 10.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.071 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.87 87.65 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.435 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -79.92 -27.01 39.92 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.02 -178.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.15 -50.47 70.3 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.611 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.0 tt -64.68 -41.47 92.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.129 176.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.448 ' HG3' HG11 ' A' ' 131' ' ' VAL . 86.7 tttt -54.83 -53.01 60.78 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.816 0.341 . . . . 0.0 110.943 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.493 ' HA ' HG22 ' A' ' 123' ' ' VAL . 20.0 m-20 -61.08 -39.14 88.79 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.584 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.433 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 89.7 t80 -60.31 -39.96 88.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.924 0.392 . . . . 0.0 109.988 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.2 mt -66.55 -41.01 89.33 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.375 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 120' ' ' ASP . 18.7 m -75.61 -19.08 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.728 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 54.1 m -82.33 0.05 43.46 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.329 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -73.77 162.87 28.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.897 0.38 . . . . 0.0 111.036 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -54.31 -64.4 0.84 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.373 -174.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 127' ' ' ARG . 40.7 mtt180 -65.2 -7.6 13.54 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 44.0 t 57.25 79.24 0.2 Allowed 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -172.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.41 140.77 57.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 -171.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.756 ' HB3' ' HB ' ' A' ' 67' ' ' THR . 39.8 tt0 -79.12 118.39 21.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.727 177.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.448 HG11 ' HG3' ' A' ' 119' ' ' LYS . 48.1 t -101.55 130.14 51.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.47 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 20.7 p -135.86 129.33 32.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.457 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.1 mp -112.43 127.23 55.97 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -120.71 150.31 41.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.972 177.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 129.17 -96.79 0.4 Allowed Glycine 0 N--CA 1.453 -0.192 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -125.51 104.85 8.64 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 174.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.499 ' HE2' ' HD2' ' A' ' 139' ' ' PRO . 0.1 OUTLIER -81.19 84.32 6.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.996 0.427 . . . . 0.0 110.077 -179.01 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.476 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 40.6 p90 -76.22 -32.78 1.15 Allowed Pre-proline 0 CA--C 1.545 0.776 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.499 ' HD2' ' HE2' ' A' ' 137' ' ' MET . 5.6 Cg_exo -77.93 119.44 4.72 Favored 'Trans proline' 0 C--N 1.365 1.402 0 C-N-CA 121.8 1.667 . . . . 0.0 112.115 -178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 69.01 -119.8 10.0 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.344 -0.455 . . . . 0.0 112.495 178.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 97.2 mttt . . . . . 0 C--O 1.237 0.404 0 C-N-CA 122.393 0.277 . . . . 0.0 110.632 -178.189 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.997 0 N-CA-C 111.921 -0.472 . . . . 0.0 111.921 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -91.57 39.04 0.99 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -172.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.429 HG23 ' ND2' ' A' ' 7' ' ' ASN . 15.3 tt -77.43 52.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-O 122.268 1.032 . . . . 0.0 108.592 172.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -71.62 -42.1 68.05 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -163.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -51.74 -50.13 61.2 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.886 0.374 . . . . 0.0 110.981 -172.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.485 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -63.29 -41.32 98.96 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.95 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.645 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 14.4 m-80 -55.7 -72.14 0.08 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.05 -63.06 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.344 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.13 -66.29 0.56 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.648 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -69.5 -43.85 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.928 -169.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.645 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 1.3 mmt -70.68 -45.27 65.35 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.778 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.25 97.49 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.511 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -81.24 -12.84 59.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.531 -177.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.525 ' HG ' HD22 ' A' ' 15' ' ' LEU . 5.5 tp -82.17 -54.33 5.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.026 0.441 . . . . 0.0 110.089 169.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.532 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 4.4 mm? -65.59 -25.55 67.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.92 -177.263 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -51.78 -42.18 62.21 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.325 0.584 . . . . 0.0 109.967 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.55 -48.82 79.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.273 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.506 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 43.6 m95 -58.32 -40.05 81.02 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.877 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 15' ' ' LEU . 41.7 mm-40 -61.36 -49.56 76.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.787 178.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.482 ' O ' HG13 ' A' ' 24' ' ' ILE . 78.9 tttt -60.61 -38.45 84.73 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.937 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -43.1 98.26 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -63.06 -39.82 95.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.303 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -61.43 -45.43 94.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.863 0.364 . . . . 0.0 110.496 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.4 mt -61.35 -36.4 72.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.442 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.1 -45.01 74.92 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -66.9 -17.91 65.13 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.988 176.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.84 48.83 3.29 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.441 173.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -150.29 128.92 12.3 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.422 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.532 0.272 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.157 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.431 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 110.467 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.668 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 15.6 ptm -144.47 112.4 6.3 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.928 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.526 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 65.7 mtt -114.22 122.82 47.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.412 -175.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -93.93 111.14 22.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 171.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 131' ' ' VAL . 30.0 t -112.14 112.29 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 122.241 -0.287 . . . . 0.0 110.96 -172.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.62 HG23 ' HB2' ' A' ' 130' ' ' GLU . 3.8 t -87.56 107.07 18.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.3 m -101.79 -40.04 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.037 -171.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.465 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 36.7 t -86.9 -55.54 3.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.482 -172.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.704 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 78.38 -4.92 57.78 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.525 -171.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -125.87 132.78 24.42 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 123.323 0.649 . . . . 0.0 109.416 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.638 ' O ' ' HB3' ' A' ' 102' ' ' SER . 35.1 Cg_endo -60.13 -16.37 39.45 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.375 2.717 . . . . 0.0 114.389 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.429 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 23.7 m -60.96 100.17 0.11 Allowed 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.933 -0.48 . . . . 0.0 110.116 173.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.43 ' CD ' ' H ' ' A' ' 74' ' ' GLU . 1.3 mp0 -57.11 -23.21 45.43 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.404 -174.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.556 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -55.46 -34.73 64.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.361 -173.315 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.413 ' O ' HD13 ' A' ' 80' ' ' ILE . 34.9 mm-40 -59.26 -50.9 72.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.314 0.578 . . . . 0.0 109.484 176.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.8 m -67.83 -29.73 68.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.815 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.36 -49.86 72.2 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -59.76 -48.37 81.96 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 110.059 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.442 HG13 ' NE2' ' A' ' 125' ' ' GLN . 1.5 mp -53.72 -54.06 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.062 178.4 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.0 m -62.82 -35.45 79.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.076 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.6 t -63.7 -57.34 10.3 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.925 0.393 . . . . 0.0 110.635 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.86 -44.23 97.24 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.811 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.53 ' CZ3' HD22 ' A' ' 122' ' ' LEU . 45.3 m0 -63.89 -38.73 92.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.532 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -59.91 -60.98 2.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.17 -52.17 13.25 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.968 177.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.1 m -59.3 -54.78 42.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.777 0.323 . . . . 0.0 111.686 -176.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 84' ' ' TRP . 9.7 mp -69.28 -29.15 66.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.405 -175.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -75.66 -30.61 59.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.6 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.35 -30.99 70.94 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.71 4.57 36.07 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.384 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.8 t30 60.91 66.19 0.93 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.146 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -115.57 101.29 8.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.57 173.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.74 73.66 1.54 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.501 0.667 . . . . 0.0 110.621 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.2 m -87.98 157.21 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.528 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.506 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.9 tp60 -110.94 100.93 9.55 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.671 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.3 OUTLIER -109.8 138.81 45.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.575 -174.008 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.416 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 68.3 m-85 -134.98 128.52 32.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.26 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.5 tt -87.87 87.57 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-O 121.926 0.87 . . . . 0.0 108.918 169.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 p -132.35 121.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.485 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 100.8 102.74 2.56 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 -163.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.638 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 41.0 m -37.67 -50.6 1.19 Allowed 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -171.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.704 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.5 p-10 -100.62 7.44 43.98 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -173.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.5 mtt180 -128.5 139.59 52.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.227 0.537 . . . . 0.0 111.809 -173.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.08 128.16 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.05 171.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.416 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 9.8 tt -98.31 123.14 50.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 121.173 0.511 . . . . 0.0 110.641 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -112.59 108.13 17.1 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.848 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.464 ' SD ' HD11 ' A' ' 15' ' ' LEU . 70.5 mtm -108.34 130.67 55.19 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.093 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 65.8 mt -117.88 122.5 43.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.119 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.452 ' HG3' HH11 ' A' ' 110' ' ' ARG . 0.0 OUTLIER -68.49 -49.86 56.56 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.021 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -113.12 111.67 22.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.977 -1.011 . . . . 0.0 108.706 172.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -108.54 43.86 1.62 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.817 -171.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 m -61.55 -31.6 71.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 110.586 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -101.99 21.31 14.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.014 -176.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.92 -54.94 40.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.581 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -31.56 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.984 -174.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -66.02 -39.55 90.32 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.078 0.466 . . . . 0.0 109.755 177.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.571 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.2 mt -60.76 -52.77 57.68 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.195 173.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.22 -48.39 54.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.94 0.4 . . . . 0.0 110.388 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -59.83 -42.82 94.39 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.995 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.57 -50.16 68.37 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.057 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 13.4 mt -57.68 -43.31 84.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.135 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -74.7 -26.9 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 120.995 -0.282 . . . . 0.0 111.572 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -78.62 2.66 18.63 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.255 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.443 ' HG3' ' HE1' ' A' ' 84' ' ' TRP . 1.1 tm0? -74.13 161.27 30.17 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.776 0.322 . . . . 0.0 111.024 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.74 -66.24 0.58 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.696 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.424 ' N ' ' OE1' ' A' ' 125' ' ' GLN . 36.1 mtm180 -69.99 -3.02 14.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.282 176.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.507 ' SG ' ' N ' ' A' ' 129' ' ' ALA . 42.1 t 73.77 176.58 0.25 Allowed 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.212 0.605 . . . . 0.0 111.48 174.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.507 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -169.8 135.24 1.43 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.711 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.62 ' HB2' HG23 ' A' ' 67' ' ' THR . 39.2 mm-40 -102.23 113.64 27.1 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 173.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.425 HG13 HG22 ' A' ' 66' ' ' VAL . 46.1 t -94.16 120.13 43.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 -177.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.6 m -107.79 130.06 55.0 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.526 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.9 mp -106.37 114.54 28.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.668 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 27.0 mm-40 -76.13 150.18 37.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 -178.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 104.47 -100.82 1.86 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.001 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -133.84 146.66 50.82 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.725 0.298 . . . . 0.0 110.554 -178.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.43 ' HA ' ' CE ' ' A' ' 137' ' ' MET . 10.2 mmt -78.24 100.55 6.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.936 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.431 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 21.5 m-85 -55.42 -53.09 66.0 Favored Pre-proline 0 CA--C 1.541 0.626 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.462 -177.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 57.9 Cg_endo -70.01 107.27 1.87 Allowed 'Trans proline' 0 C--N 1.359 1.118 0 C-N-CA 121.859 1.706 . . . . 0.0 111.953 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 113.61 -22.42 15.0 Favored Glycine 0 N--CA 1.454 -0.149 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.989 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 66.5 mttm . . . . . 0 C--O 1.235 0.322 0 C-N-CA 122.357 0.263 . . . . 0.0 110.47 -179.599 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.748 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -79.02 76.76 5.51 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.03 0.443 . . . . 0.0 110.138 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.8 tt -81.24 64.63 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 122.122 0.963 . . . . 0.0 110.335 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.549 ' HA ' ' HB2' ' A' ' 7' ' ' ASN . 12.1 mtp180 -70.69 -17.54 62.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.732 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.403 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 13.2 t70 -54.55 -52.34 62.36 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.513 ' OH ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -66.27 -44.51 83.38 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.17 178.667 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.549 ' HB2' ' HA ' ' A' ' 4' ' ' ARG . 25.3 m-80 -51.3 -78.58 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.239 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.96 -59.88 3.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.788 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.583 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -67.86 -60.6 2.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -171.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.616 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 12.8 t70 -69.66 -39.13 77.25 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.974 -169.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.518 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 2.0 mmt -64.42 -45.5 87.31 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.65 -42.58 71.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.871 0.367 . . . . 0.0 110.218 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.616 ' HD2' ' HA ' ' A' ' 10' ' ' ASP . 81.9 mtt180 -54.09 -62.38 1.69 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.083 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.499 HD12 HD22 ' A' ' 15' ' ' LEU . 3.9 pp -80.33 -18.41 49.24 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -171.304 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.499 HD22 HD12 ' A' ' 14' ' ' LEU . 3.5 mm? -79.34 -30.49 42.73 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.132 -0.355 . . . . 0.0 110.945 175.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -50.09 -39.02 41.33 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.265 0.555 . . . . 0.0 110.513 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -61.28 -38.93 88.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.238 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.503 ' CZ2' ' HG2' ' A' ' 108' ' ' MET . 61.7 m95 -66.15 -42.48 88.98 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.211 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -62.59 -46.68 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.557 ' O ' HG13 ' A' ' 24' ' ' ILE . 22.9 tttm -51.58 -54.33 28.81 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.729 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.8 -38.88 76.79 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -173.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -60.0 -45.63 92.13 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.396 0.617 . . . . 0.0 109.377 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 36.9 m-20 -66.54 -28.56 68.64 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.4 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 20' ' ' LYS . 60.1 mt -70.83 -42.85 77.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.255 176.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -73.32 -16.97 61.35 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.047 0.451 . . . . 0.0 109.972 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.454 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.5 tp10 -58.89 -15.15 11.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.443 0.64 . . . . 0.0 109.639 168.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.45 28.14 11.99 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.238 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -160.51 158.88 30.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.1 mm? . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.941 -175.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 62.9 mt . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.588 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 21.8 ptp -138.53 114.34 9.93 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.772 171.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 86.0 mtp -108.88 117.81 35.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.535 -173.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.528 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 1.3 m-85 -97.42 121.31 39.17 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.0 t -117.11 105.51 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.787 0.327 . . . . 0.0 110.492 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 10.1 m -78.29 105.84 9.8 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.765 HG11 HG21 ' A' ' 80' ' ' ILE . 41.3 t -88.97 -61.77 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.482 -170.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.515 ' HB2' ' HG3' ' A' ' 76' ' ' GLU . 47.4 t -92.59 -46.46 7.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.332 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.96 2.97 87.74 Favored Glycine 0 CA--C 1.519 0.287 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -168.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -121.81 132.0 24.32 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 102' ' ' SER . 46.5 Cg_endo -63.43 -15.46 48.58 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.59 2.86 . . . . 0.0 116.058 -165.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.7 133.01 45.35 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.184 0.902 . . . . 0.0 112.437 -169.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -50.33 -42.14 52.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.386 -1.279 . . . . 0.0 113.589 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.882 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.0 mptp? -49.15 -60.84 2.45 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -165.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.515 ' HG3' ' HB2' ' A' ' 69' ' ' SER . 2.1 pm0 -50.81 -60.39 3.11 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.053 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.679 ' HA ' HG22 ' A' ' 80' ' ' ILE . 45.5 m -71.08 -28.36 64.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.841 -174.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.38 -52.24 66.45 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.464 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 43.6 mt-10 -64.97 -48.0 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.243 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.765 HG21 HG11 ' A' ' 68' ' ' VAL . 10.6 tp -62.31 -41.96 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.74 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 96.5 m -67.26 -32.95 74.32 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.862 0.363 . . . . 0.0 110.433 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.2 t -62.47 -40.31 96.22 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.648 HD12 HD12 ' A' ' 80' ' ' ILE . 77.0 mt -62.58 -44.75 95.53 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.434 ' NE1' HG13 ' A' ' 80' ' ' ILE . 49.0 m0 -57.25 -37.36 72.2 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.601 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.455 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 0.7 OUTLIER -62.3 -61.49 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.732 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.51 -19.84 43.03 Favored Glycine 0 CA--C 1.523 0.542 0 CA-C-N 115.683 -0.689 . . . . 0.0 114.266 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.534 ' HB2' HD12 ' A' ' 88' ' ' LEU . 18.1 m -96.38 -69.33 0.76 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.081 0.44 . . . . 0.0 111.193 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.534 HD12 ' HB2' ' A' ' 87' ' ' SER . 4.7 mp -78.51 -57.46 3.76 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.952 0.406 . . . . 0.0 111.259 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.455 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 94.9 m-85 -68.85 -11.34 60.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.251 -173.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -71.98 -27.04 62.5 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.771 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.96 3.67 22.14 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.038 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 62.99 66.33 0.75 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.625 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -84.46 160.71 20.5 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.154 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -95.37 15.88 18.32 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.094 0.473 . . . . 0.0 110.93 -177.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.3 t -88.17 151.55 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.96 176.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -132.39 140.86 48.65 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.05 159.03 42.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.482 -0.192 . . . . 0.0 110.482 -173.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -138.53 154.84 48.78 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.695 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.3 tt -115.5 89.82 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.011 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -118.42 132.73 67.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 173.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 61.3 82.89 0.07 OUTLIER Glycine 0 C--N 1.332 0.34 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 -166.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.42 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 16.9 m -43.69 -42.15 5.17 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -166.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -52.46 -21.7 3.98 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.513 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 33.0 ttt180 -133.12 133.2 42.61 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 110.741 -175.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.88 134.39 52.13 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.2 tt -108.55 132.74 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.72 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -106.09 123.78 48.55 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.425 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.503 ' HG2' ' CZ2' ' A' ' 18' ' ' TRP . 2.1 mpt? -96.11 114.0 25.66 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 171.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.461 ' N ' HD22 ' A' ' 109' ' ' LEU . 2.2 mm? -101.34 103.81 14.78 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.471 -178.197 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.8 mmm-85 -76.24 -50.34 14.71 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 166.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -104.37 110.65 22.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.518 172.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -110.68 11.76 30.15 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.358 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.1 t -58.54 -40.19 82.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.103 0.478 . . . . 0.0 110.423 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -97.85 21.35 10.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.536 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.33 -37.65 88.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.057 0.456 . . . . 0.0 110.404 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -22.76 62.36 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.646 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -73.08 -37.42 66.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.449 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 mt -63.09 -47.82 90.74 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.26 173.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -57.46 -41.84 81.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -58.31 -44.93 88.83 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.343 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' PHE . . . . . 0.412 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 73.1 t80 -64.02 -50.35 68.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.249 177.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 96.4 mt -49.64 -43.91 47.16 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.941 177.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.655 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 28.7 m -84.83 -14.35 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-O 120.971 0.415 . . . . 0.0 111.033 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -80.27 1.1 29.91 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.121 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.42 ' HB2' ' HA ' ' A' ' 128' ' ' CYS . 11.6 mt-30 -71.84 165.09 24.83 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.965 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -54.21 -64.99 0.65 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.635 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -101.05 -15.46 17.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.052 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.655 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 48.8 t 70.88 170.11 0.32 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.068 0.547 . . . . 0.0 111.154 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.453 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -135.91 171.19 14.82 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.734 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.567 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 44.3 mt-10 -84.34 115.04 22.29 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.597 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -87.83 132.9 31.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.528 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 9.2 m -131.51 138.17 48.84 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.704 ' HB2' ' HG2' ' A' ' 137' ' ' MET . 35.1 mt -122.2 111.91 17.53 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -178.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.588 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 28.3 mm-40 -93.14 136.25 33.58 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.4 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.66 -60.08 0.44 Allowed Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 111.605 -0.598 . . . . 0.0 111.605 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -170.41 133.98 1.11 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.704 ' HG2' ' HB2' ' A' ' 133' ' ' LEU . 72.7 mtp -105.75 114.44 28.6 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.082 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.528 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 86.6 m-85 -61.29 -52.69 69.12 Favored Pre-proline 0 CA--C 1.541 0.626 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.1 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 19.8 Cg_endo -57.68 121.48 10.11 Favored 'Trans proline' 0 C--N 1.361 1.2 0 C-N-CA 122.217 1.945 . . . . 0.0 112.308 -175.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 99.03 -21.37 46.22 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.33 -0.462 . . . . 0.0 112.28 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 C--N 1.33 -0.278 0 CA-C-O 120.818 0.342 . . . . 0.0 110.575 -179.767 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.893 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -92.93 162.86 13.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.527 0.204 . . . . 0.0 111.106 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.697 HG12 ' HB3' ' A' ' 6' ' ' TYR . 9.5 tt 48.57 29.75 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.511 1.125 . . . . 0.0 112.408 174.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -56.01 -34.2 65.59 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.387 -177.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.53 -48.01 69.44 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.556 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.697 ' HB3' HG12 ' A' ' 3' ' ' ILE . 2.8 t80 -57.55 -47.11 82.94 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.402 ' N ' HD22 ' A' ' 7' ' ' ASN . 0.9 OUTLIER -52.78 -68.11 0.2 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.731 -177.367 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -54.63 -67.65 0.25 Allowed 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.343 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.55 -58.67 7.3 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.728 -171.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -66.4 -56.74 9.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.749 -172.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.631 ' SD ' ' HD2' ' A' ' 65' ' ' PHE . 10.5 mmt -59.63 -49.99 75.63 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.793 0.33 . . . . 0.0 110.663 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.13 -51.8 49.54 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.994 0.426 . . . . 0.0 111.291 -175.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.5 mtt180 -82.47 -6.99 59.64 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.993 -170.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -91.7 -52.54 4.71 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 11' ' ' MET . 4.0 mm? -72.65 -15.59 61.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.289 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -48.4 -41.03 27.81 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.859 0.838 . . . . 0.0 109.51 170.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.4 ' HG3' ' HD2' ' A' ' 20' ' ' LYS . 30.1 tt0 -68.19 -40.23 82.28 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.963 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 3.3 m95 -60.49 -41.44 94.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.86 0.362 . . . . 0.0 110.776 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.69 -47.01 88.17 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.559 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.6 tmtt? -52.3 -44.57 65.1 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.443 177.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.403 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 30.5 m-20 -67.18 -45.96 75.4 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.641 0.257 . . . . 0.0 111.393 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -58.32 -41.53 84.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.826 0.346 . . . . 0.0 110.678 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 22.0 m-20 -67.76 -36.1 79.9 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.782 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.8 mt -58.39 -43.42 86.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 175.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -37.59 87.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 37.5 tt0 -56.55 -22.39 32.99 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.91 174.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.73 31.78 14.7 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.27 -0.49 . . . . 0.0 112.34 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -141.22 129.3 22.05 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--O 1.235 0.335 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.53 -179.971 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 109' ' ' LEU . 2.2 tm? . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.509 0.671 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.655 ' SD ' ' HG3' ' A' ' 108' ' ' MET . 50.5 mtm -133.38 136.35 45.24 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 166.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.461 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 60.4 mtt -118.53 117.65 29.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.196 -174.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.631 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 16.6 m-85 -90.06 101.61 14.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 172.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.6 t -92.56 106.7 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.639 0.257 . . . . 0.0 111.264 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.601 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 87.7 m -83.06 108.28 16.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.65 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 42.7 t -100.97 -60.75 2.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.978 0.418 . . . . 0.0 111.523 -174.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.597 ' HB3' ' HB3' ' A' ' 76' ' ' GLU . 77.7 p -92.9 -60.33 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.3 19.99 79.79 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -164.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.483 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 19.0 t-20 -127.34 133.18 24.79 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 115.19 -0.505 . . . . 0.0 109.822 -176.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 20.5 Cg_exo -65.0 -18.99 63.68 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.249 2.633 . . . . 0.0 114.704 -170.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 40.7 p -61.61 133.42 55.62 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.103 0.478 . . . . 0.0 111.769 -176.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.78 -29.17 70.51 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -177.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.563 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.97 -37.75 61.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.864 -176.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 69' ' ' SER . 5.3 mm-40 -55.04 -68.4 0.19 Allowed 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.821 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.5 t -64.4 -38.38 90.82 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.921 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.56 -61.66 2.34 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.765 0.317 . . . . 0.0 110.575 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.5 mt-10 -60.87 -50.01 75.15 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.247 -175.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.663 HD12 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -64.57 -43.7 96.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.088 -173.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.3 m -64.78 -34.27 77.95 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.635 0.255 . . . . 0.0 110.359 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -62.57 -40.2 96.11 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.663 HD12 HD12 ' A' ' 80' ' ' ILE . 82.3 mt -60.53 -45.75 92.67 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.132 0.491 . . . . 0.0 110.143 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.624 ' HZ3' ' HB3' ' A' ' 105' ' ' ALA . 44.3 m0 -60.79 -57.35 13.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.718 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.533 ' O ' ' HB2' ' A' ' 89' ' ' PHE . 26.0 tt0 -61.51 -23.6 66.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.075 0.464 . . . . 0.0 110.484 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.47 -31.89 58.38 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.026 175.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.2 m -94.23 -63.42 1.19 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.492 HD21 HG13 ' A' ' 118' ' ' ILE . 6.1 mp -62.23 -46.99 86.37 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -173.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.533 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 33.8 m-85 -71.36 -11.32 60.84 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.467 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -70.46 -46.3 64.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 173.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.79 -10.17 59.21 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.977 173.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.7 t30 72.59 48.42 0.22 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.14 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -74.36 100.83 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -73.39 84.38 1.46 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.43 0.633 . . . . 0.0 110.933 -175.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.79 HG12 HD21 ' A' ' 109' ' ' LEU . 4.5 m -111.29 162.01 9.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.115 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.468 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.1 tp60 -101.32 103.79 14.78 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 173.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.597 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -102.04 130.16 48.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.439 -175.834 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -119.63 136.44 54.39 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.6 tt -118.65 107.07 20.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.281 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.48 139.87 10.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.07 103.23 0.13 Allowed Glycine 0 C--O 1.224 -0.488 0 C-N-CA 120.342 -0.933 . . . . 0.0 111.584 -176.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 p -46.85 -35.27 6.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.549 ' HB2' HG21 ' A' ' 3' ' ' ILE . 12.7 t70 -53.23 -38.96 63.41 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.601 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 51.7 mtt180 -138.31 167.43 21.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 122.182 0.991 . . . . 0.0 112.821 -167.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.624 ' HB3' ' HZ3' ' A' ' 84' ' ' TRP . . . -143.88 153.84 42.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.543 162.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.437 HG12 ' SD ' ' A' ' 108' ' ' MET . 12.4 tt -127.0 145.56 34.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -170.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -122.34 120.11 33.06 Favored 'General case' 0 CA--C 1.523 -0.063 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.978 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.655 ' HG3' ' SD ' ' A' ' 63' ' ' MET . 4.3 mpp? -103.45 124.09 48.08 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 173.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.79 HD21 HG12 ' A' ' 95' ' ' VAL . 9.1 mt -128.46 141.21 51.47 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.406 0.622 . . . . 0.0 111.479 -177.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.1 mtp-105 -105.91 6.28 31.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.255 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -139.31 138.75 36.97 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -121.57 24.96 7.06 Favored Glycine 0 N--CA 1.453 -0.2 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.474 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.0 m -60.3 -37.75 81.51 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.243 0.544 . . . . 0.0 110.482 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -117.13 24.96 10.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.853 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.07 -47.51 82.63 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.201 0.524 . . . . 0.0 111.061 -178.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -76.72 -20.1 56.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.175 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.14 -48.88 31.76 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.245 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.492 HG13 HD21 ' A' ' 88' ' ' LEU . 8.4 tt -63.5 -41.19 91.81 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.07 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.461 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 63.9 tttm -58.83 -45.27 90.42 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.268 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.3 -40.73 87.11 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.29 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -65.11 -44.2 89.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.1 mt -60.74 -38.63 85.79 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.369 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 31.2 m -87.38 -12.0 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-O 120.853 0.358 . . . . 0.0 111.174 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 17.7 t -86.77 2.05 50.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.383 175.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -60.75 164.31 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.149 -176.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -54.44 -61.64 2.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.32 178.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -80.95 -11.28 59.6 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.55 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 60.0 m 65.77 114.62 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.087 0.555 . . . . 0.0 110.979 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -102.61 144.9 30.42 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.914 -177.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -91.61 127.25 36.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.974 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 43.6 t -106.53 109.86 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.254 -174.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.503 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 31.4 p -92.7 127.12 38.09 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.47 HD12 ' HG2' ' A' ' 137' ' ' MET . 83.0 mt -87.19 163.17 17.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.926 0.393 . . . . 0.0 111.593 -172.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 62.2 tt0 -59.83 116.49 4.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.333 -0.848 . . . . 0.0 111.412 176.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 72.01 -73.53 0.85 Allowed Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.94 -0.573 . . . . 0.0 113.368 173.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -161.08 154.93 22.34 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -177.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.47 ' HG2' HD12 ' A' ' 133' ' ' LEU . 85.8 mtp -62.34 110.73 1.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.842 0.354 . . . . 0.0 110.443 176.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.629 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 35.1 p90 -72.07 -31.48 1.73 Allowed Pre-proline 0 CA--C 1.547 0.83 0 CA-C-O 118.8 -0.619 . . . . 0.0 112.659 177.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.629 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 37.0 Cg_endo -65.27 123.96 12.27 Favored 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 121.197 1.264 . . . . 0.0 111.155 173.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 105.87 153.02 20.69 Favored Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 C--O 1.237 0.412 0 CA-C-O 120.678 0.275 . . . . 0.0 110.424 -179.379 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 112.101 -0.4 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -113.08 108.56 17.49 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt -78.36 -2.81 5.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.105 -176.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -56.64 -38.78 72.6 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.841 -178.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.77 -49.27 77.15 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 177.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -55.72 -43.31 76.41 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.954 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.448 ' OD1' ' HD2' ' A' ' 104' ' ' ARG . 0.9 OUTLIER -58.46 -53.34 59.39 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.151 -177.254 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -52.68 -61.56 2.21 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.84 -61.45 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.509 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.78 -60.0 4.36 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.075 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.441 ' O ' HD23 ' A' ' 15' ' ' LEU . 26.2 mmt -59.4 -52.1 67.08 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.226 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.72 89.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.794 0.33 . . . . 0.0 111.084 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -72.15 -23.94 61.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.748 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.1 tp -80.71 -52.69 7.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.94 0.4 . . . . 0.0 110.625 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -68.08 -20.61 64.96 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.432 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -48.78 -38.28 21.48 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.504 0.668 . . . . 0.0 109.873 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -69.16 -43.68 73.78 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.002 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -59.04 -41.86 88.84 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 120.897 0.38 . . . . 0.0 110.715 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -61.71 -46.28 90.33 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.465 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.5 tmtt? -55.77 -40.88 73.24 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.439 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.438 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 7.4 m-20 -71.03 -44.67 65.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.33 -31.6 72.8 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 121.169 0.509 . . . . 0.0 109.808 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 6.2 m-20 -66.62 -44.98 80.6 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.766 174.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.3 mt -61.26 -34.18 59.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -69.09 -31.33 69.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.004 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.0 tp10 -64.99 -17.85 64.79 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.262 0.553 . . . . 0.0 110.071 170.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.68 29.42 13.6 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.239 -178.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -136.93 126.14 24.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 177.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.446 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.9 mm? . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.629 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.257 0 CA-C-O 121.161 0.505 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 13.5 ptm -145.21 116.06 7.77 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.551 175.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 67.0 mtt -120.23 144.77 47.57 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.55 -174.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' HB3' ' HD3' ' A' ' 104' ' ' ARG . 41.6 m-85 -123.75 100.31 6.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.954 177.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.584 HG21 HD13 ' A' ' 122' ' ' LEU . 16.3 t -91.96 109.73 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -171.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 57.9 m -79.91 104.69 10.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.07 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.429 HG11 HG12 ' A' ' 80' ' ' ILE . 25.5 t -101.86 -58.82 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.049 0.452 . . . . 0.0 111.193 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.721 ' HB2' ' HA ' ' A' ' 103' ' ' ASP . 5.1 m -65.44 -69.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.217 -170.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.21 3.66 89.72 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.45 -0.66 . . . . 0.0 111.45 -171.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 28.4 t-20 -123.13 136.16 26.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 33.6 Cg_exo -60.35 -19.34 57.78 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.284 2.656 . . . . 0.0 114.301 -173.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 m -81.63 140.96 34.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.24 -0.287 . . . . 0.0 110.446 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -72.75 -19.67 61.33 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -171.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -32.16 -61.02 0.26 Allowed 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.616 0.722 . . . . 0.0 112.29 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.41 -51.98 63.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.617 -169.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.581 HG23 HD11 ' A' ' 99' ' ' ILE . 9.6 t -66.04 -33.97 77.01 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.83 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.21 -52.63 57.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.897 0.38 . . . . 0.0 110.126 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.1 -49.4 76.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.104 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.559 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.1 tp -67.52 -42.96 87.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -175.11 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.408 HG21 ' HB ' ' A' ' 99' ' ' ILE . 73.4 m -68.7 -25.13 64.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.685 0.279 . . . . 0.0 110.405 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.8 t -67.31 -48.52 67.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 173.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.486 HD12 HD12 ' A' ' 80' ' ' ILE . 86.1 mt -55.24 -43.7 74.81 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.335 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 53.8 m0 -67.01 -43.83 81.9 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.118 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -55.16 -28.83 55.71 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.365 0.602 . . . . 0.0 109.592 175.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -76.26 -68.2 1.57 Allowed Glycine 0 CA--C 1.518 0.233 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.225 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.7 m -57.54 -54.4 47.24 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.3 mp -64.1 -29.0 70.16 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 111.281 -172.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -101.29 6.24 42.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.475 0.655 . . . . 0.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -89.68 -32.33 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 167.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.56 -14.39 37.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.637 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.0 m120 66.51 80.33 0.22 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.269 176.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -111.58 120.71 43.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.793 171.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.42 83.03 1.95 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.239 0.542 . . . . 0.0 110.254 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.624 HG23 ' HD2' ' A' ' 97' ' ' ARG . 12.5 m -111.07 148.78 14.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.852 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.447 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.5 tp60 -100.79 100.56 11.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.785 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -125.67 141.23 52.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.204 -169.425 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.46 ' O ' HG22 ' A' ' 106' ' ' ILE . 81.5 m-85 -138.72 135.63 34.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.304 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.581 HD11 HG23 ' A' ' 77' ' ' THR . 5.0 tt -87.0 89.76 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.536 0.684 . . . . 0.0 109.445 173.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -135.28 130.71 51.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.307 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 93.83 103.43 1.7 Allowed Glycine 0 C--O 1.225 -0.465 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -171.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -40.9 -34.9 0.45 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.721 ' HA ' ' HB2' ' A' ' 69' ' ' SER . 7.8 p-10 -89.56 -48.4 7.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.521 0.2 . . . . 0.0 111.472 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.529 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 61.6 mtt180 -88.51 155.0 19.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -173.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -128.35 140.72 51.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.379 165.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 98' ' ' PHE . 8.0 tt -109.69 132.09 58.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 111.433 -172.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -123.22 107.69 11.98 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.261 176.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.419 ' SD ' HD11 ' A' ' 15' ' ' LEU . 66.5 mtm -102.1 118.81 37.68 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.52 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 28.6 mt -110.89 131.39 55.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.436 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 29.8 mmm-85 -88.99 4.26 48.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.347 0.594 . . . . 0.0 109.601 173.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -146.13 135.08 22.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.336 176.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -114.11 23.54 12.65 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.99 -176.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.2 t -64.67 -44.87 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -101.61 26.52 7.25 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.005 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -50.38 72.88 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.131 0.491 . . . . 0.0 111.753 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -28.54 62.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 -177.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -69.02 -48.41 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.42 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.587 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.2 tt -63.93 -41.41 92.41 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.497 ' HG2' HG11 ' A' ' 131' ' ' VAL . 14.1 tmtt? -57.56 -49.88 74.92 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 121.05 0.452 . . . . 0.0 110.229 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -56.65 -40.79 76.08 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.553 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -66.14 -47.71 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.918 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 88.8 mt -53.46 -44.77 69.18 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.403 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 28.7 m -81.77 -14.68 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.734 0.302 . . . . 0.0 111.481 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -74.26 1.55 11.17 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.769 0.427 . . . . 0.0 111.633 175.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.559 ' HG2' HD11 ' A' ' 80' ' ' ILE . 0.9 OUTLIER -76.85 164.53 25.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.401 0.619 . . . . 0.0 112.408 -174.269 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -79.76 -45.67 18.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.567 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -66.84 -3.17 6.22 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.726 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 43.6 t 62.51 91.32 0.07 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.222 0.534 . . . . 0.0 110.403 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.16 132.69 45.38 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.537 -177.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -108.27 124.53 50.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.841 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.508 ' HA ' ' HA ' ' A' ' 66' ' ' VAL . 6.5 p -102.84 127.97 56.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.103 0.478 . . . . 0.0 111.735 -173.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.6 m -87.06 121.33 29.37 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.2 tt -105.2 113.45 27.05 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -172.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -120.11 151.36 39.17 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.068 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 112.92 43.32 0.87 Allowed Glycine 0 N--CA 1.454 -0.137 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.099 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 70.35 144.47 0.06 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.331 0.586 . . . . 0.0 111.155 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 29.3 mmt -90.15 110.02 21.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.275 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.638 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 75.3 m-85 -58.55 -51.47 81.62 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.821 178.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.638 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 47.4 Cg_endo -91.5 179.21 1.57 Allowed 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 122.467 2.111 . . . . 0.0 112.309 177.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 86.37 -77.27 2.04 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.306 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 85.2 tttt . . . . . 0 C--O 1.236 0.371 0 CA-C-O 120.631 0.253 . . . . 0.0 110.558 -178.139 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 111.748 -0.541 . . . . 0.0 111.748 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -94.61 -54.99 3.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.211 0.529 . . . . 0.0 109.779 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mm -94.16 -31.65 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.007 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -56.41 -50.54 71.33 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.588 0.233 . . . . 0.0 111.609 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.86 -48.97 74.59 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -47.84 73.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.176 176.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.575 ' O ' ' HB2' ' A' ' 11' ' ' MET . 93.4 m-20 -53.12 -76.41 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.947 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.64 -64.07 0.94 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.832 -176.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.548 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -65.59 -61.24 2.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.846 -171.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -74.95 -30.49 61.23 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -168.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.575 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 10.0 mmt -71.42 -37.43 71.48 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.222 175.053 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.92 -48.08 83.15 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.16 173.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 85.7 mtt180 -59.05 -45.31 91.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.188 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.509 HD21 ' HD2' ' A' ' 98' ' ' PHE . 61.3 tp -71.1 -53.2 15.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.853 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.465 HD23 ' O ' ' A' ' 11' ' ' MET . 4.1 mm? -69.12 -18.59 63.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.129 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -48.74 -49.95 35.91 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.021 0.439 . . . . 0.0 110.799 175.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.452 ' HG3' ' N ' ' A' ' 18' ' ' TRP . 7.1 pt20 -66.71 -35.22 79.61 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.548 -177.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.466 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 76.8 m95 -67.03 -42.24 85.2 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.088 0.471 . . . . 0.0 110.428 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.07 -48.89 79.94 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.581 ' O ' HG13 ' A' ' 24' ' ' ILE . 88.2 tttt -57.59 -45.75 84.9 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.668 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -58.13 -54.16 50.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.984 0.421 . . . . 0.0 110.846 -177.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.54 -39.36 79.98 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.669 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 4.0 m-20 -72.56 -30.73 64.68 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.514 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 20' ' ' LYS . 67.9 mt -65.11 -37.75 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.91 -26.7 60.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.547 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 4.9 mm-40 -62.14 -17.32 57.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.233 166.066 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.46 9.76 62.75 Favored Glycine 0 N--CA 1.453 -0.203 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.824 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.91 124.96 47.3 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 C--N 1.327 -0.379 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' HG ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.425 0 CA-C-O 121.901 0.858 . . . . 0.0 113.254 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.609 ' HE3' ' HG3' ' A' ' 134' ' ' GLU . 72.9 mtm -142.32 133.66 26.36 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.307 168.073 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.53 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 63.0 mtt -114.64 129.15 56.64 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -172.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.518 ' HE1' ' HA ' ' A' ' 134' ' ' GLU . 43.5 m-85 -91.1 116.46 28.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 168.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -112.96 108.2 24.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.665 0.269 . . . . 0.0 110.965 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 37.8 m -77.15 106.52 8.92 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.418 HG21 HG23 ' A' ' 77' ' ' THR . 97.9 t -85.24 -61.05 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.081 0.467 . . . . 0.0 111.682 -172.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.5 t -91.65 -41.61 10.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.931 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.56 -10.18 65.41 Favored Glycine 0 C--N 1.33 0.243 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -167.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.407 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 25.7 t-20 -126.23 130.82 23.85 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 123.865 0.866 . . . . 0.0 109.004 178.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 80.0 Cg_exo -46.3 -16.61 0.25 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.185 3.257 . . . . 0.0 116.263 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.9 p -60.18 97.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.682 0.674 . . . . 0.0 112.347 -172.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.413 ' CA ' ' HB3' ' A' ' 102' ' ' SER . 40.0 tt0 -43.34 -30.92 0.57 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.132 -0.94 . . . . 0.0 112.415 176.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -35.04 -66.9 0.16 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 123.998 0.811 . . . . 0.0 111.935 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -62.93 -43.75 97.94 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.975 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.418 HG23 HG21 ' A' ' 68' ' ' VAL . 38.6 m -63.93 -39.8 94.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.282 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.54 -50.01 60.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.384 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.84 -54.16 45.97 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 120.985 0.422 . . . . 0.0 110.929 177.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.635 HD12 HD12 ' A' ' 83' ' ' LEU . 10.2 tp -67.07 -40.0 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.324 -174.066 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.461 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 70.5 m -61.48 -37.34 83.26 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.673 0.273 . . . . 0.0 110.394 176.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.401 ' HA ' HE21 ' A' ' 85' ' ' GLN . 50.9 m -61.02 -44.84 96.82 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 80' ' ' ILE . 78.3 mt -58.53 -47.48 84.04 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 176.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.416 ' CE2' HG13 ' A' ' 80' ' ' ILE . 48.9 m0 -58.7 -45.87 88.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.093 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.6 mt-30 -58.51 -60.03 4.44 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.44 -40.06 10.73 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.342 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 m -73.17 -58.02 3.61 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 111.373 -178.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.3 mt -57.99 -54.14 50.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -174.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -65.94 -31.13 71.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.38 -174.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.66 -24.07 59.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.282 0.563 . . . . 0.0 109.723 176.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.13 14.4 12.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.43 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.5 t30 73.26 9.46 5.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.703 175.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -81.28 91.92 6.29 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.038 -0.413 . . . . 0.0 109.968 176.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.77 94.46 7.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.08 165.25 16.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.316 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.499 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.1 tp60 -104.53 152.97 21.74 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 177.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.538 ' N ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -155.65 126.82 7.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.78 0.324 . . . . 0.0 110.36 -177.465 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.509 ' HD2' HD21 ' A' ' 14' ' ' LEU . 15.8 m-30 -113.82 124.15 51.53 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 tt -102.32 88.77 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 122.136 0.97 . . . . 0.0 109.734 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.39 141.98 45.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.111 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 67.19 76.27 0.39 Allowed Glycine 0 C--O 1.224 -0.489 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -169.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.413 ' HB3' ' CA ' ' A' ' 74' ' ' GLU . 24.6 m -35.21 -34.6 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -165.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.76 -34.17 72.63 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.176 0.513 . . . . 0.0 111.849 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 88.3 mtt180 -128.09 134.69 49.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.162 0.506 . . . . 0.0 111.93 -171.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.64 128.56 54.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.539 -0.755 . . . . 0.0 108.975 173.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.6 tt -104.46 133.14 49.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 110.704 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -116.11 129.62 56.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.07 -177.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.573 ' HA ' ' HG2' ' A' ' 63' ' ' MET . 2.0 mpt? -108.87 122.71 47.77 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.679 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' A' ' 62' ' ' LEU . 0.8 OUTLIER -128.01 114.75 17.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 172.1 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -61.79 -34.32 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -170.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -118.38 111.49 18.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.101 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.54 48.46 3.9 Favored Glycine 0 C--N 1.332 0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.166 -174.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.4 t -68.39 -71.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.981 0.419 . . . . 0.0 110.003 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.1 p90 -80.54 30.17 0.3 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.631 177.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.82 -41.53 82.42 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.234 0.54 . . . . 0.0 111.445 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.413 ' HA ' ' HE3' ' A' ' 119' ' ' LYS . 21.0 m95 -75.11 -32.89 61.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.009 -174.164 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.83 -53.57 44.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.153 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.592 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.2 tt -61.62 -38.36 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.079 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.53 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 24.5 ttpp -53.51 -55.55 24.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.144 0.497 . . . . 0.0 110.788 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.668 ' HA ' HG22 ' A' ' 123' ' ' VAL . 3.3 m-20 -64.22 -30.99 72.02 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.846 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -64.93 -36.51 84.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.959 0.409 . . . . 0.0 110.034 176.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 81.3 mt -67.43 -46.26 73.67 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.278 178.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.668 HG22 ' HA ' ' A' ' 120' ' ' ASP . 12.5 m -82.21 -4.51 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.582 -177.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.4 t -70.04 1.24 4.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.92 0.488 . . . . 0.0 111.765 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -83.19 143.11 30.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.007 0.432 . . . . 0.0 111.529 -174.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -43.89 -62.35 1.15 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.063 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 48.9 ttt180 -80.78 21.24 0.69 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 56.6 m 70.99 -166.94 0.15 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.701 0.4 . . . . 0.0 111.779 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 171.71 119.41 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.603 -176.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 34.8 mt-10 -87.17 144.14 26.98 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.2 p -138.72 139.72 40.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.926 0.393 . . . . 0.0 111.302 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 18.2 p -138.33 140.47 39.51 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 176.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 137' ' ' MET . 61.3 mt -88.4 154.31 20.48 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.639 0.257 . . . . 0.0 111.172 -176.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.609 ' HG3' ' HE3' ' A' ' 63' ' ' MET . 1.7 tm-20 -69.0 138.71 54.75 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 70.3 17.11 73.91 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.629 -172.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 74.61 167.25 0.29 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.745 0.818 . . . . 0.0 110.999 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.443 ' HA ' HD12 ' A' ' 133' ' ' LEU . 27.1 ttt -60.57 107.03 0.62 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.622 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.52 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 37.0 m-85 -55.44 -52.39 72.07 Favored Pre-proline 0 CA--C 1.542 0.635 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.052 -176.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.52 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 72.5 Cg_endo -76.01 127.08 9.75 Favored 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 121.842 1.695 . . . . 0.0 111.994 179.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 110.77 -121.63 5.93 Favored Glycine 0 C--N 1.331 0.301 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt . . . . . 0 C--O 1.235 0.303 0 CA-C-O 120.658 0.266 . . . . 0.0 110.439 -178.887 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -80.38 55.62 2.31 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.199 0.524 . . . . 0.0 110.938 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.778 HG12 ' HB3' ' A' ' 6' ' ' TYR . 15.0 tt -82.59 40.61 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 CA-C-O 122.316 1.055 . . . . 0.0 109.039 176.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -55.41 -43.41 75.25 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 114.495 -1.23 . . . . 0.0 112.274 -169.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.98 -46.13 71.59 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.082 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.778 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -58.57 -47.15 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.989 176.656 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.571 ' O ' ' HB2' ' A' ' 11' ' ' MET . 90.6 m-20 -55.15 -71.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.405 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -51.23 -69.47 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.093 -178.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.17 -58.75 7.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.746 -171.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.96 -45.97 55.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.915 -168.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.571 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 17.2 mmt -69.01 -43.27 75.14 Favored 'General case' 0 N--CA 1.461 0.125 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.707 -176.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.47 -49.94 67.19 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.835 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -67.95 -27.81 66.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.653 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -78.78 -52.09 8.86 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.891 0.377 . . . . 0.0 111.2 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -72.55 -25.13 61.25 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -173.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -59.75 -29.45 68.17 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -55.8 -58.11 9.21 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.854 174.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.1 m95 -58.94 -30.15 67.67 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.667 -178.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.82 -62.89 1.53 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.379 175.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.478 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.1 ttmt -57.37 -47.14 82.42 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.152 -178.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.42 -46.49 73.21 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 123.377 0.423 . . . . 0.0 110.632 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 28.6 t70 -61.64 -41.9 98.14 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.141 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -66.89 -24.87 66.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.08 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 20' ' ' LYS . 70.5 mt -71.28 -37.5 66.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 174.08 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -68.34 -31.55 71.02 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.571 173.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 22' ' ' ASP . 14.9 mm-40 -69.21 -35.38 76.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.349 0.595 . . . . 0.0 109.645 172.372 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.64 48.02 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.726 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -116.88 94.2 4.5 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.434 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.533 0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.027 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--O 1.235 0.296 0 CA-C-O 121.062 0.458 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.677 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 17.1 ptm -140.87 111.74 7.07 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.867 176.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.5 mtt -113.47 130.21 56.38 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.385 -174.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -100.05 118.86 37.31 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.442 HG22 HG13 ' A' ' 131' ' ' VAL . 35.4 t -113.94 101.7 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 -175.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.645 HG23 ' HB2' ' A' ' 130' ' ' GLU . 5.1 t -83.19 106.2 14.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 109.459 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.438 HG11 HG12 ' A' ' 80' ' ' ILE . 17.3 t -101.29 -60.78 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.831 -173.062 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.3 t -72.57 -59.7 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.685 -176.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.508 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 75.62 0.92 64.57 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.523 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.459 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 22.9 t-20 -126.26 132.29 24.26 Favored Pre-proline 0 CA--C 1.535 0.367 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 32.6 Cg_exo -58.71 -17.91 38.2 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.628 2.886 . . . . 0.0 114.513 -171.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.1 p -57.9 107.16 0.43 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 111.912 -178.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -47.61 -31.27 4.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.04 0.936 . . . . 0.0 112.641 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.618 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 11.9 mptt -49.29 -50.88 37.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.135 0.493 . . . . 0.0 111.081 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.3 -50.33 74.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.452 -174.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.456 HG23 HD11 ' A' ' 99' ' ' ILE . 14.6 t -67.83 -39.47 83.88 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.793 -175.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.06 -53.3 59.91 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -54.95 -63.13 1.25 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.135 179.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.438 HG12 HG11 ' A' ' 68' ' ' VAL . 11.4 tp -63.41 -46.35 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.599 -171.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.4 HG21 ' HB ' ' A' ' 99' ' ' ILE . 55.3 m -67.99 -31.72 71.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.488 -0.132 . . . . 0.0 111.159 -177.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.1 t -67.73 -44.45 77.57 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 177.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 99.3 mt -60.69 -40.94 94.05 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.508 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 40.1 m0 -62.98 -47.79 81.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.664 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -55.73 -57.84 10.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.027 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -43.93 -58.34 4.33 Favored Glycine 0 C--N 1.333 0.395 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.991 173.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -49.53 75.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.59 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 95.3 mt -60.71 -56.57 19.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.083 -177.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -68.34 -20.3 64.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.07 -177.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -68.73 -38.0 79.85 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.164 0.507 . . . . 0.0 110.197 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.8 5.72 50.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.224 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 64.64 65.12 0.64 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.596 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.59 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 17.4 m-85 -102.1 88.16 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 168.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -77.21 72.57 3.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 109.785 -177.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.856 HG12 HD21 ' A' ' 109' ' ' LEU . 4.5 m -104.62 161.02 4.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.015 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.467 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.4 tp60 -102.0 105.42 16.18 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.744 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -119.96 145.35 46.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.972 -174.448 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.474 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 81.8 m-85 -130.97 127.01 37.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.068 0.461 . . . . 0.0 109.951 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.456 HD11 HG23 ' A' ' 77' ' ' THR . 7.5 tt -99.26 90.51 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.935 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -136.86 128.71 43.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.584 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.26 97.99 0.15 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 -172.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.9 m -45.19 -32.58 1.93 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -172.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.508 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 2.5 m-20 -57.47 -51.92 67.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.471 177.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.438 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 69.9 mtt180 -120.92 134.37 55.3 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -171.244 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.91 127.96 55.06 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 168.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.474 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 6.1 tt -98.71 132.94 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.989 0.423 . . . . 0.0 111.257 -177.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -124.22 123.8 41.05 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.593 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 76.6 mtm -128.12 146.81 50.59 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.267 0.556 . . . . 0.0 111.41 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.856 HD21 HG12 ' A' ' 95' ' ' VAL . 22.4 mt -133.28 137.64 46.1 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.436 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.37 -55.42 4.17 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 172.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -128.3 111.51 13.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.466 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.91 95.91 0.12 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.308 -176.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.5 t -70.66 -23.39 62.5 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 109.872 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.29 14.36 1.23 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.914 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.74 75.38 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.051 0.453 . . . . 0.0 111.529 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 16.8 m95 -79.49 -23.86 42.7 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.185 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -72.67 -48.45 39.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.881 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.1 tt -64.17 -41.29 91.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.6 -41.45 81.26 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.8 -40.8 94.04 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.153 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -60.66 -40.44 92.04 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.435 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 47.7 mt -65.96 -40.55 91.39 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.256 -178.215 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 24.6 m -81.07 -22.91 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 120.809 0.338 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.5 m -87.17 2.7 49.11 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.127 0.489 . . . . 0.0 110.583 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.508 ' NE2' ' NE1' ' A' ' 84' ' ' TRP . 6.6 tp-100 -66.74 156.47 35.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.621 -174.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -45.16 -67.74 0.26 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.001 0.52 . . . . 0.0 111.879 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -69.77 -17.84 63.45 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.604 177.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 42.3 t 68.8 116.59 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.609 0.568 . . . . 0.0 109.919 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.59 143.28 32.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.934 -175.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.645 ' HB2' HG23 ' A' ' 67' ' ' THR . 38.9 mt-10 -91.66 113.39 25.64 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.01 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.442 HG13 HG22 ' A' ' 66' ' ' VAL . 37.5 t -104.25 138.73 27.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -178.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.5 p -125.54 136.34 53.22 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.56 HD12 ' HG2' ' A' ' 137' ' ' MET . 62.4 mt -94.13 110.89 22.58 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.677 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 53.8 mm-40 -67.03 129.82 41.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 -177.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 96.5 6.02 58.73 Favored Glycine 0 CA--C 1.518 0.222 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 -171.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 74.44 160.45 0.23 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.908 0.883 . . . . 0.0 111.709 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.56 ' HG2' HD12 ' A' ' 133' ' ' LEU . 76.9 mtp -69.58 101.32 1.6 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.299 -177.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.667 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 35.7 p90 -73.69 -28.36 0.91 Allowed Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.312 173.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.667 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 37.9 Cg_endo -66.2 118.34 5.43 Favored 'Trans proline' 0 C--N 1.369 1.617 0 C-N-CA 121.455 1.437 . . . . 0.0 111.309 171.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 81.33 -126.2 7.27 Favored Glycine 0 C--N 1.332 0.31 0 N-CA-C 111.454 -0.658 . . . . 0.0 111.454 -177.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 N--CA 1.466 0.372 0 CA-C-N 116.944 0.372 . . . . 0.0 110.363 177.676 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.78 0 N-CA-C 111.753 -0.539 . . . . 0.0 111.753 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -120.58 166.41 13.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.977 0.417 . . . . 0.0 110.83 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt -107.55 11.92 8.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 121.969 0.89 . . . . 0.0 108.796 174.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.5 ttm105 -51.95 -31.79 30.41 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.524 -176.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -54.73 -45.6 74.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.627 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.0 -44.04 98.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 178.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.566 ' O ' ' HB2' ' A' ' 11' ' ' MET . 1.1 m-80 -53.77 -70.39 0.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.45 -62.68 1.5 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.935 -175.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.49 -64.27 1.0 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.758 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -68.0 -39.44 83.23 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.672 -169.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 24.2 mmt -70.52 -45.99 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.979 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -59.65 -43.64 93.81 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.052 0.454 . . . . 0.0 110.484 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -72.54 -31.68 65.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.469 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.9 tp -71.59 -52.77 16.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.962 0.411 . . . . 0.0 110.29 177.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.76 -17.02 61.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.174 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 16.5 tp10 -51.07 -49.75 60.04 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 121.268 0.556 . . . . 0.0 110.206 173.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 21' ' ' ASP . 18.2 tt0 -64.93 -43.01 94.14 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 m95 -55.09 -41.88 72.16 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.612 0.57 . . . . 0.0 110.833 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.28 -52.32 66.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.649 ' HE2' HD11 ' A' ' 24' ' ' ILE . 88.2 tttt -62.22 -27.68 69.15 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.946 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 17' ' ' GLN . 35.6 m-20 -67.83 -49.39 62.47 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -72.27 -25.84 61.76 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.052 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -61.97 -54.6 39.45 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.285 0.564 . . . . 0.0 110.391 171.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.649 HD11 ' HE2' ' A' ' 20' ' ' LYS . 77.8 mt -59.17 -35.87 59.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.995 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.97 -42.64 99.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.195 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -78.2 3.29 15.62 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.034 0.445 . . . . 0.0 110.93 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.22 53.12 3.21 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 116.236 -0.438 . . . . 0.0 113.95 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -158.64 136.2 10.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.034 0.417 . . . . 0.0 111.171 175.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.578 HD13 HG12 ' A' ' 24' ' ' ILE . 2.5 mm? . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.416 HD13 ' HB1' ' A' ' 115' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 121.719 0.771 . . . . 0.0 112.738 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.453 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 18.0 ptp -136.47 127.27 27.37 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.739 -1.118 . . . . 0.0 108.786 172.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.7 mtt -110.35 125.32 53.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 0.0 111.344 -173.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.504 ' HE2' ' SD ' ' A' ' 11' ' ' MET . 49.8 m-85 -102.91 105.01 15.29 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.644 HG21 HD13 ' A' ' 122' ' ' LEU . 21.7 t -98.11 105.41 17.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.245 -171.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.8 m -79.02 103.5 9.01 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.63 HG11 HG12 ' A' ' 80' ' ' ILE . 26.0 t -96.18 -62.71 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.811 0.338 . . . . 0.0 111.739 -171.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.6 t -92.56 -64.3 1.12 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.426 -173.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 89.78 -9.25 77.86 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 -172.047 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -92.72 125.49 55.33 Favored Pre-proline 0 CA--C 1.532 0.273 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.38 -19.8 68.38 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.172 2.581 . . . . 0.0 114.21 -170.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.448 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.5 m -66.04 113.93 4.83 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 52.3 mt-10 -60.45 -24.65 65.39 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -168.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.534 ' HD3' ' N ' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -49.96 -31.23 12.07 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.894 0.378 . . . . 0.0 111.593 -178.911 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.534 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 31.6 mm-40 -60.37 -60.09 4.37 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.083 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.647 ' HB ' ' HA ' ' A' ' 102' ' ' SER . 15.1 t -62.82 -33.43 75.21 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.511 -178.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -54.94 -59.29 4.94 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.08 176.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -57.47 -54.54 45.71 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.149 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.657 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.6 tp -63.91 -44.95 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.779 -171.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.436 HG21 ' HB ' ' A' ' 99' ' ' ILE . 39.5 m -67.03 -34.29 77.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.543 0.211 . . . . 0.0 110.61 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.2 t -63.62 -45.09 91.83 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.896 0.379 . . . . 0.0 110.201 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.6 mt -62.64 -44.73 95.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.553 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.402 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 20.8 m0 -65.37 -43.78 89.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.859 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -60.2 -29.71 68.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.313 0.578 . . . . 0.0 110.091 172.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -77.9 -26.12 61.02 Favored Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 112.307 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.0 m -96.11 -56.26 2.7 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.96 -49.26 76.25 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.702 0.287 . . . . 0.0 111.597 -175.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -71.05 -21.62 62.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.769 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.25 -35.09 66.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.232 0.539 . . . . 0.0 109.762 174.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.65 7.32 34.09 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.481 176.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.3 t30 65.82 70.39 0.44 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.463 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -130.3 95.77 3.99 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.293 171.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -84.16 70.87 10.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.615 0.721 . . . . 0.0 109.669 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 31.8 m -95.77 169.48 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.07 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.42 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -101.48 104.7 15.64 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.877 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.59 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.4 OUTLIER -111.51 138.49 47.97 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.25 -178.376 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.451 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.4 m-85 -130.0 150.85 51.1 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 175.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.436 ' HB ' HG21 ' A' ' 81' ' ' THR . 6.9 tt -130.75 96.81 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.399 -171.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -149.01 133.38 9.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 80.59 102.72 0.3 Allowed Glycine 0 C--O 1.227 -0.314 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.083 -173.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.647 ' HA ' ' HB ' ' A' ' 77' ' ' THR . 18.9 t -53.85 -28.27 34.85 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.913 0.387 . . . . 0.0 111.924 -174.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.584 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 10.0 p-10 -61.42 -36.84 81.45 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -134.39 141.2 46.77 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.54 137.75 53.01 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 167.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.451 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 10.2 tt -111.81 128.24 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.15 0.5 . . . . 0.0 111.633 -172.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -121.18 117.96 28.45 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.615 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.2 mtm -115.76 133.47 56.0 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.716 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 109' ' ' LEU . 4.2 mp -132.51 155.44 48.59 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.751 -176.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 110' ' ' ARG . 44.7 mtm105 -105.86 6.01 31.19 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 167.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -100.59 149.54 23.63 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.883 -177.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -131.36 19.16 4.87 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 175.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.9 t -93.98 -60.37 1.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.725 0.298 . . . . 0.0 110.222 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -99.07 8.26 45.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.937 0.398 . . . . 0.0 110.568 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.416 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -54.79 -38.03 66.79 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.21 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -76.11 -35.42 59.31 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.217 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -58.94 -52.5 65.48 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.406 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.6 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 4.3 tt -60.08 -42.53 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.34 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.471 ' HB3' ' HZ2' ' A' ' 119' ' ' LYS . 4.2 ttpm? -52.51 -54.88 26.62 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.344 0.592 . . . . 0.0 110.912 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.61 ' HA ' HG22 ' A' ' 123' ' ' VAL . 2.6 m-20 -65.17 -31.02 72.0 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.875 -177.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -64.48 -45.1 88.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.644 HD13 HG21 ' A' ' 66' ' ' VAL . 74.5 mt -58.36 -45.19 88.67 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.852 177.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.61 HG22 ' HA ' ' A' ' 120' ' ' ASP . 14.3 m -77.5 -17.51 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.758 0.313 . . . . 0.0 111.539 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -81.1 2.38 27.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 178.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.657 ' HG2' HD11 ' A' ' 80' ' ' ILE . 6.3 tp-100 -68.01 163.32 22.53 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.092 -174.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -66.08 -46.21 78.52 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.208 0.527 . . . . 0.0 109.752 -176.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -70.29 -20.94 63.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.432 174.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.4 m 66.11 167.33 0.21 Allowed 'General case' 0 CA--C 1.534 0.332 0 O-C-N 123.716 0.635 . . . . 0.0 109.296 -167.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.48 146.56 6.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.844 0.354 . . . . 0.0 111.322 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -94.53 112.78 24.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.553 176.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -96.55 112.34 28.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.218 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 65.3 p -95.43 132.16 40.8 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 67.7 mt -99.26 117.51 33.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -175.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.453 ' HB3' ' HG3' ' A' ' 63' ' ' MET . 10.8 tp10 -115.78 150.68 36.52 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.855 0.359 . . . . 0.0 110.54 -177.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 111.11 -81.46 0.29 Allowed Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 111.646 -0.582 . . . . 0.0 111.646 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -130.96 114.21 14.95 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.675 0.274 . . . . 0.0 110.591 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.39 117.21 19.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.71 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.567 ' H ' ' HD2' ' A' ' 139' ' ' PRO . 23.1 m-85 -94.87 -51.79 0.24 Allowed Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.567 ' HD2' ' H ' ' A' ' 138' ' ' TYR . 27.3 Cg_endo -60.02 114.12 1.95 Allowed 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 122.139 1.892 . . . . 0.0 112.825 -174.135 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 72.0 -78.06 0.66 Allowed Glycine 0 C--N 1.333 0.399 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.502 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.325 -0.472 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 -179.259 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 112.109 -0.396 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -68.94 -48.43 63.25 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.124 0.488 . . . . 0.0 110.657 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.654 HG21 ' HB2' ' A' ' 103' ' ' ASP . 16.0 tt -117.42 16.82 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-O 121.866 0.841 . . . . 0.0 109.498 -177.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.484 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 59.4 ttt-85 -59.55 -29.38 67.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.514 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -57.53 -46.5 83.77 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.457 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.1 OUTLIER -56.15 -44.33 79.17 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.702 173.223 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -53.45 -76.38 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -179.059 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.5 -59.83 4.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.485 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.571 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.94 -57.16 10.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.905 -171.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -69.58 -45.06 69.54 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.771 -171.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.421 ' SD ' ' HD2' ' A' ' 65' ' ' PHE . 25.4 mmt -63.72 -37.59 87.91 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.1 -50.58 72.68 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.848 0.356 . . . . 0.0 110.394 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 66.8 mtm180 -57.63 -45.5 85.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.268 -176.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -75.48 -52.23 11.17 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.537 -176.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.408 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -75.53 -15.95 60.33 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -172.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.62 -35.15 65.57 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.14 -42.04 99.41 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.485 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -61.44 -41.82 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.743 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.98 -42.74 94.28 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.503 ' O ' HG13 ' A' ' 24' ' ' ILE . 3.1 tttm -52.99 -52.09 59.47 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.048 176.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.432 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 13.5 m-20 -69.45 -35.63 75.84 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.442 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -56.9 -48.93 77.05 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -62.39 -44.81 95.57 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.12 177.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 20' ' ' LYS . 64.5 mt -59.03 -42.21 85.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.723 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.88 -13.2 59.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.538 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.65 -11.75 61.09 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.48 0.657 . . . . 0.0 109.312 166.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.24 28.1 11.18 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 114.288 171.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -154.07 152.5 30.54 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 169.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.6 mm? . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.43 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 HD13 ' A' ' 109' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.164 0.506 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.408 ' SD ' HD12 ' A' ' 15' ' ' LEU . 45.7 mtm -134.13 136.96 44.2 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 170.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.648 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 61.2 mtt -120.26 118.22 29.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.45 . . . . 0.0 111.185 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 13.1 m-85 -92.41 102.9 15.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 172.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.517 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 18.6 t -94.22 105.03 16.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.156 -170.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 47.7 m -77.25 101.4 6.22 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.015 178.069 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.475 HG11 HG21 ' A' ' 80' ' ' ILE . 42.8 t -101.43 -60.67 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.755 -177.342 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 t -81.75 -68.07 0.73 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.845 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.661 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 81.88 -10.71 51.15 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -169.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -109.25 133.73 20.69 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -64.5 -17.37 59.39 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.98 2.453 . . . . 0.0 114.702 -169.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.0 p -60.36 112.0 1.78 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.338 0.517 . . . . 0.0 111.221 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.419 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 10.4 pt-20 -57.98 -15.59 9.49 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.872 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -47.16 -54.18 11.25 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.075 175.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -58.5 -55.73 31.22 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.276 -0.874 . . . . 0.0 110.884 -172.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.495 ' HA ' HG22 ' A' ' 80' ' ' ILE . 10.6 t -63.73 -31.87 73.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.592 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.49 -52.95 62.38 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.208 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -58.03 -54.78 43.08 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.046 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.609 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.8 tp -65.32 -42.83 94.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.318 -173.234 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 86.2 m -68.38 -28.07 66.78 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.675 0.274 . . . . 0.0 110.436 178.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 48.3 t -62.85 -48.76 77.64 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 73.9 mt -58.67 -52.36 66.03 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.098 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.8 m0 -63.13 -29.97 71.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.406 -177.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.26 -60.19 3.73 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.42 -33.11 16.13 Favored Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.25 -0.887 . . . . 0.0 113.671 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.0 m -84.05 -67.89 0.76 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.77 -56.55 13.19 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 112.112 -172.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -76.53 -15.16 59.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.641 -170.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -80.32 -23.87 40.33 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.65 10.6 22.56 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.719 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.0 m120 70.63 24.89 4.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.826 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -71.54 100.07 2.18 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 173.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -85.36 69.86 10.75 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.495 0.664 . . . . 0.0 110.366 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.4 HG12 ' HG ' ' A' ' 109' ' ' LEU . 24.4 m -107.47 159.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.024 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.406 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -100.53 136.93 39.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.587 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -140.58 135.55 31.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.088 -169.304 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.415 ' O ' HG22 ' A' ' 106' ' ' ILE . 28.4 m-85 -130.46 132.37 45.65 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.587 174.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.483 HD11 HG23 ' A' ' 77' ' ' THR . 6.9 tt -109.69 89.75 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 109.9 179.084 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -138.24 131.77 41.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.85 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.03 98.47 0.11 Allowed Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 -172.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.419 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 15.0 m -49.29 -27.76 4.14 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.984 0.514 . . . . 0.0 112.315 -174.243 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.661 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 35.7 t70 -47.33 -47.37 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.561 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.517 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 51.0 mtt180 -135.98 147.09 47.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.557 0.694 . . . . 0.0 112.616 -172.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -112.32 122.5 47.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 166.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.712 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.7 tt -98.49 133.63 40.14 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.74 -173.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -126.89 109.63 12.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.504 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.712 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.5 mpp? -96.8 124.57 40.82 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 178.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.422 HD13 HD12 ' A' ' 62' ' ' LEU . 6.0 mp -111.72 102.98 11.24 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.55 -32.88 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 176.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -141.63 126.89 18.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.173 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 167.11 118.4 0.44 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.521 -0.847 . . . . 0.0 113.161 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.5 m -81.25 -18.86 44.52 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -79.57 33.7 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.11 -175.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.421 ' O ' HG22 ' A' ' 118' ' ' ILE . . . -61.95 -59.5 5.02 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.135 0.493 . . . . 0.0 111.857 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -26.94 64.06 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.884 0.373 . . . . 0.0 110.241 -176.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.52 -52.5 52.17 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.368 177.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.584 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 tt -62.57 -39.58 85.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.5 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 84.3 tttt -58.16 -43.16 87.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.12 176.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.565 ' HA ' HG22 ' A' ' 123' ' ' VAL . 27.0 t70 -63.56 -37.48 87.47 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.233 0.539 . . . . 0.0 110.181 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -66.14 -33.06 74.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.829 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.0 mt -68.72 -47.73 65.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.355 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.565 HG22 ' HA ' ' A' ' 120' ' ' ASP . 18.9 m -73.58 -8.67 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.2 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -65.32 -0.12 1.68 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.954 171.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.609 ' HG2' HD11 ' A' ' 80' ' ' ILE . 1.8 mp0 -101.59 85.94 2.85 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -178.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -55.71 -28.96 58.49 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.492 -175.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.513 ' O ' ' SG ' ' A' ' 128' ' ' CYS . 71.3 mtt85 -61.7 -46.25 90.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.18 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 127' ' ' ARG . 97.7 m -168.2 123.47 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -177.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.499 ' HB1' ' HA ' ' A' ' 123' ' ' VAL . . . -164.22 93.64 0.7 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.053 0.454 . . . . 0.0 111.526 -177.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.476 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 40.5 mt-10 -127.04 150.01 49.65 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 172.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.2 p -155.43 142.24 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.855 0.36 . . . . 0.0 111.348 -176.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 41.5 p -126.71 138.19 53.36 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.648 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 6.0 mp -97.68 172.24 7.83 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.569 -0.16 . . . . 0.0 110.569 -175.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.34 86.78 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -177.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 63.01 -79.29 0.03 OUTLIER Glycine 0 CA--C 1.521 0.418 0 N-CA-C 114.786 0.675 . . . . 0.0 114.786 169.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -65.77 123.18 19.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.006 0.432 . . . . 0.0 111.973 -170.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.425 ' HA ' ' CE ' ' A' ' 137' ' ' MET . 5.0 mmt -80.5 105.19 11.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.718 174.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.429 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 4.8 m-85 -67.05 -53.15 27.05 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.553 -175.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.429 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 58.8 Cg_endo -70.82 103.74 1.38 Allowed 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.881 1.721 . . . . 0.0 112.612 -177.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 63.71 -114.5 6.91 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.808 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 86.5 tttt . . . . . 0 C--O 1.237 0.419 0 CA-C-O 120.88 0.372 . . . . 0.0 110.479 179.853 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.624 0 N-CA-C 111.876 -0.49 . . . . 0.0 111.876 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -114.66 168.03 10.23 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 3' ' ' ILE . 13.6 tt -137.8 23.1 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.547 0.689 . . . . 0.0 110.279 -176.025 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.516 ' HA ' HD22 ' A' ' 7' ' ' ASN . 49.6 ttt180 -56.02 -35.22 66.61 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.418 -177.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.23 -43.88 61.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.299 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.452 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -62.36 -42.21 99.22 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.883 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.531 ' O ' ' HB2' ' A' ' 11' ' ' MET . 49.0 m-80 -58.87 -66.4 0.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.865 -177.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -51.79 -60.82 2.73 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.454 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.571 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . . . -56.08 -70.95 0.1 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.58 -176.214 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 2.7 m-20 -60.9 -56.83 16.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.452 -174.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.531 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 10.8 mmt -60.84 -49.63 76.72 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.18 -172.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.483 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -64.14 -44.78 91.14 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.582 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.571 ' NH1' ' HA ' ' A' ' 9' ' ' ALA . 54.5 mtt85 -85.78 -1.95 57.74 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 17' ' ' GLN . 55.9 tp -95.56 -46.68 6.55 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 171.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.643 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -76.0 -20.96 57.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.373 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 31.3 tp10 -48.61 -40.54 27.88 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.776 0.798 . . . . 0.0 109.019 170.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.47 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 54.7 tt0 -60.26 -58.85 6.74 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 114.304 -1.317 . . . . 0.0 110.336 175.53 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 47.9 m95 -53.06 -38.45 62.48 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.682 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 43.3 mt-10 -67.52 -44.31 78.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.148 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.471 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -60.16 -50.0 75.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.158 177.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -58.03 -36.87 73.34 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 178.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.63 -50.48 72.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.411 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.73 -38.31 89.99 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.052 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.2 mt -63.02 -41.12 91.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.833 0.349 . . . . 0.0 110.546 178.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.44 -23.03 58.86 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.18 0.514 . . . . 0.0 109.883 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -72.19 -17.09 61.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.556 0.693 . . . . 0.0 109.368 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.48 21.29 35.05 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.898 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -132.43 115.83 16.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--N 1.33 -0.274 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.425 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.637 HD11 ' HE3' ' A' ' 64' ' ' MET . 3.3 tm? . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.643 ' SD ' HD12 ' A' ' 15' ' ' LEU . 21.6 ptt? -147.28 131.55 17.47 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.107 167.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.637 ' HE3' HD11 ' A' ' 62' ' ' LEU . 58.9 mtt -118.42 138.43 52.46 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.7 -170.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -103.83 114.31 28.47 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 168.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.563 HG21 HD13 ' A' ' 122' ' ' LEU . 21.6 t -114.39 112.03 38.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 118.007 0.367 . . . . 0.0 110.959 -172.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.659 HG23 ' HB2' ' A' ' 130' ' ' GLU . 7.9 t -98.16 123.81 42.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.06 -60.59 2.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.21 -174.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.7 t -92.8 -57.46 2.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.339 -172.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.72 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 91.25 29.64 12.16 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -168.082 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.673 ' HB3' ' HG3' ' A' ' 76' ' ' GLU . 28.9 t-20 -125.19 132.77 24.39 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 122.858 0.463 . . . . 0.0 110.325 -178.364 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.4 -17.11 34.9 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.381 2.721 . . . . 0.0 114.406 -173.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 m -81.47 139.37 35.23 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 112.069 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -41.44 -49.24 3.9 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.631 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -39.1 -41.8 0.85 Allowed 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.773 0.671 . . . . 0.0 112.495 -167.688 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.673 ' HG3' ' HB3' ' A' ' 71' ' ' ASN . 9.8 mm-40 -59.74 -70.47 0.16 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.273 -174.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.455 HG21 ' HA ' ' A' ' 102' ' ' SER . 15.2 t -61.73 -38.64 88.67 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.859 0.361 . . . . 0.0 110.648 -178.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -53.67 -62.65 1.52 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.612 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.443 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 51.9 mt-10 -71.41 -38.69 71.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.816 -173.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.48 HD12 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -66.48 -39.94 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.395 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 90.2 m -69.02 -34.54 75.42 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.5 m -57.44 -45.21 84.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.109 174.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.48 HD12 HD12 ' A' ' 80' ' ' ILE . 83.6 mt -61.13 -51.86 67.29 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.225 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.4 m0 -62.25 -27.62 69.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.525 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.19 -57.74 3.99 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 174.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.01 -12.72 7.53 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 115.693 -0.685 . . . . 0.0 113.672 176.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.4 m -95.92 -67.98 0.82 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 117.084 0.442 . . . . 0.0 110.862 174.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.5 mp -66.34 -56.45 11.05 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.713 -172.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -66.13 -26.45 67.45 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.176 -176.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -72.16 -30.29 64.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 0.0 109.657 175.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.0 5.9 24.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.542 175.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 76.32 17.8 1.95 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.333 176.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -78.79 91.87 4.77 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.067 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -82.79 71.96 9.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.55 0.69 . . . . 0.0 109.967 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.412 HG12 HD21 ' A' ' 109' ' ' LEU . 5.6 m -88.14 178.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.421 178.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.583 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 4.9 tp60 -109.95 142.1 41.8 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 119.731 -0.787 . . . . 0.0 109.759 171.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.414 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.06 134.94 17.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.083 -178.01 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.438 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 29.5 m-85 -116.87 134.57 54.61 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 175.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -100.02 90.56 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.827 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.39 137.02 46.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.97 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.452 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 75.26 101.97 0.11 Allowed Glycine 0 C--O 1.225 -0.433 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 -169.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.455 ' HA ' HG21 ' A' ' 77' ' ' THR . 15.2 m -60.31 -10.08 4.27 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.72 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 4.1 p-10 -100.46 -4.85 28.03 Favored 'General case' 0 C--O 1.239 0.517 0 O-C-N 121.974 -0.454 . . . . 0.0 111.179 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 75.4 mtt180 -131.89 151.94 51.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.524 0.678 . . . . 0.0 111.831 -173.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.57 136.17 51.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.209 166.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.502 ' CD1' HD21 ' A' ' 15' ' ' LEU . 4.7 tt -112.46 128.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.429 . . . . 0.0 110.809 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -118.02 145.94 44.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.967 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.583 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -141.61 147.62 37.92 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-O 121.472 0.654 . . . . 0.0 110.837 175.864 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.412 HD21 HG12 ' A' ' 95' ' ' VAL . 89.6 mt -131.93 136.02 47.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.893 -177.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -92.47 -31.2 15.35 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 164.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.14 110.22 22.21 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.942 -1.026 . . . . 0.0 108.361 170.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -113.45 13.42 23.17 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.303 -173.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.4 t -61.55 -20.17 62.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.757 0.313 . . . . 0.0 111.366 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -118.68 19.02 13.32 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.862 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.492 ' HB1' ' HG ' ' A' ' 62' ' ' LEU . . . -62.03 -44.93 95.65 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.01 -176.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -33.88 77.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -174.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -61.16 -46.69 89.49 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.191 0.52 . . . . 0.0 109.745 177.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -62.04 -42.28 94.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.828 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -52.99 -53.56 48.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.114 0.483 . . . . 0.0 110.181 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.442 ' HA ' HG22 ' A' ' 123' ' ' VAL . 0.8 OUTLIER -60.35 -36.44 77.99 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.035 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -65.19 -48.55 73.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 0.0 110.046 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.563 HD13 HG21 ' A' ' 66' ' ' VAL . 88.3 mt -53.6 -47.07 70.53 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.459 177.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 120' ' ' ASP . 21.3 m -79.5 -13.74 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.363 -178.271 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.9 t -74.56 2.28 10.08 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.857 0.361 . . . . 0.0 111.457 175.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -78.26 164.81 24.57 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.019 0.438 . . . . 0.0 111.586 -176.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.9 -63.66 1.07 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.04 -172.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -75.16 -5.28 43.52 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.216 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 45.7 t 61.42 104.41 0.02 OUTLIER 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.318 0.58 . . . . 0.0 109.79 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.62 133.14 45.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.845 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.659 ' HB2' HG23 ' A' ' 67' ' ' THR . 50.3 mm-40 -83.35 113.25 20.6 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.481 HG23 HG22 ' A' ' 66' ' ' VAL . 7.5 p -109.7 134.22 52.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.851 -175.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 22.9 p -122.37 143.24 49.78 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 31.6 mt -107.67 135.23 49.45 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -175.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.63 141.39 29.93 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.94 -127.52 9.22 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.955 -0.458 . . . . 0.0 111.955 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -135.2 145.0 47.27 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 84.7 mtp -73.71 116.1 13.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.535 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.58 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 49.7 p90 -73.27 -31.26 1.38 Allowed Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 176.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 65.2 Cg_endo -73.02 101.96 1.39 Allowed 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 121.256 1.304 . . . . 0.0 111.495 173.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 115.61 -107.53 1.73 Allowed Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.684 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 95.7 mttt . . . . . 0 C--O 1.235 0.309 0 CA-C-O 120.685 0.278 . . . . 0.0 110.553 -178.128 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.703 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -171.83 -58.93 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.073 0.463 . . . . 0.0 110.609 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.614 HG12 ' HD2' ' A' ' 6' ' ' TYR . 12.8 tt -110.95 4.96 8.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.09 -173.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.567 ' HA ' ' OD1' ' A' ' 7' ' ' ASN . 99.2 mtt180 -58.72 -13.52 6.21 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -177.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.47 -49.84 71.44 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.519 177.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.614 ' HD2' HG12 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -69.68 -37.61 76.71 Favored 'General case' 0 C--N 1.338 0.065 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.626 -178.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 4' ' ' ARG . 14.7 m120 -48.9 -69.24 0.12 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 176.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.24 -68.12 0.22 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.047 -177.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.34 -59.97 4.45 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.665 -171.562 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.452 ' HB3' ' O ' ' A' ' 6' ' ' TYR . 23.5 t70 -66.91 -48.17 69.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.741 -170.274 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.55 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 6.0 mmt -69.98 -47.07 63.74 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.974 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.42 81.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.97 0.414 . . . . 0.0 110.764 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -68.87 -19.51 64.24 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.167 -178.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.18 -52.52 16.17 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 169.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.44 HD23 ' O ' ' A' ' 11' ' ' MET . 4.4 mm? -69.91 -15.08 63.01 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.808 -176.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -48.41 -55.49 10.7 Favored 'General case' 0 C--O 1.247 0.95 0 CA-C-O 121.533 0.682 . . . . 0.0 111.055 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -66.09 -29.59 69.95 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.53 -178.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.465 ' CH2' ' SD ' ' A' ' 108' ' ' MET . 45.2 m95 -64.05 -41.66 97.31 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -57.91 -47.91 81.45 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.51 ' O ' HG13 ' A' ' 24' ' ' ILE . 83.7 tttt -57.23 -40.71 78.11 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.04 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -62.17 -51.64 67.03 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.727 0.299 . . . . 0.0 110.948 -175.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.67 -25.48 60.28 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.745 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -39.67 85.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.767 0.318 . . . . 0.0 110.16 171.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.2 mt -62.5 -37.82 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -65.58 -34.95 79.44 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.922 175.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -71.37 -20.28 62.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.362 0.601 . . . . 0.0 109.68 174.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.05 35.05 7.28 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.796 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -143.82 132.13 22.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 176.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.4 mm? . . . . . 0 C--O 1.238 0.459 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.415 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.453 HD13 ' HA3' ' A' ' 112' ' ' GLY . 3.0 tt . . . . . 0 C--O 1.235 0.312 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.522 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 22.7 ptp -126.41 124.54 40.41 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.155 -179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.458 ' HG2' ' CD2' ' A' ' 133' ' ' LEU . 55.6 mtt -107.68 118.03 35.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.466 -176.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.453 ' CZ ' HD12 ' A' ' 106' ' ' ILE . 9.5 m-85 -100.49 126.55 46.92 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.413 HG11 ' CH2' ' A' ' 84' ' ' TRP . 25.8 t -113.01 100.72 11.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.856 0.36 . . . . 0.0 110.303 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.649 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 34.5 m -74.31 99.01 3.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.719 175.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.597 HG11 HG21 ' A' ' 80' ' ' ILE . 58.5 t -96.4 -55.94 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.195 0.521 . . . . 0.0 110.634 -175.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.419 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 9.7 m -87.36 -63.3 1.33 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.483 -172.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 82.1 -10.62 52.68 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 -169.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.468 ' ND2' ' HD2' ' A' ' 72' ' ' PRO . 27.0 t-20 -126.52 137.53 30.57 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.468 ' HD2' ' ND2' ' A' ' 71' ' ' ASN . 18.7 Cg_endo -55.6 -17.21 16.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.876 3.051 . . . . 0.0 115.261 -171.129 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 9.8 p -49.78 100.02 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -176.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.46 ' H ' ' HG3' ' A' ' 74' ' ' GLU . 11.9 mt-10 -31.95 -44.94 0.09 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.928 1.291 . . . . 0.0 113.247 175.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.883 ' HD2' ' H ' ' A' ' 75' ' ' LYS . 3.1 mptp? -51.58 -48.47 63.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.342 -166.292 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.419 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 14.7 mm-40 -58.66 -56.71 18.68 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.204 -174.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.481 HG21 ' HA ' ' A' ' 102' ' ' SER . 14.6 t -64.59 -37.13 86.5 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.559 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.91 -55.25 37.3 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 54.0 mt-10 -58.77 -55.44 35.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.769 -178.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.597 HG21 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -63.26 -47.4 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.499 -172.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.481 HG21 ' HB ' ' A' ' 99' ' ' ILE . 45.0 m -68.88 -31.67 70.77 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.206 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 18.9 t -68.82 -41.23 78.9 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 98.6 mt -61.21 -46.47 90.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.413 ' CH2' HG11 ' A' ' 66' ' ' VAL . 40.8 m0 -61.65 -36.58 81.19 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.841 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -59.52 -65.95 0.59 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -51.39 -28.73 21.28 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.325 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.8 m -87.82 -61.76 1.65 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.641 0.721 . . . . 0.0 111.923 -178.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.1 -53.68 46.72 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.261 0.553 . . . . 0.0 111.248 -176.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -76.76 -10.81 59.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.533 -171.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -84.92 -33.19 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 172.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.21 2.21 28.78 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.187 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 74.12 20.15 2.8 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.707 175.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -82.86 71.19 9.96 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 171.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.26 82.27 3.74 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.466 0.651 . . . . 0.0 110.665 -176.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.4 m -87.76 175.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.023 174.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.504 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 5.6 tp60 -99.77 120.68 40.12 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.03 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.696 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -119.72 125.89 49.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.719 -164.526 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -128.38 113.15 15.21 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.481 ' HB ' HG21 ' A' ' 81' ' ' THR . 6.0 tt -100.27 90.19 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.635 0.731 . . . . 0.0 109.505 175.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.76 125.01 51.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.498 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.01 102.01 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.147 -0.781 . . . . 0.0 111.147 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.481 ' HA ' HG21 ' A' ' 77' ' ' THR . 21.9 m -47.47 -22.14 0.42 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.453 ' HB2' HG21 ' A' ' 3' ' ' ILE . 17.4 t70 -54.34 -60.49 3.28 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.311 177.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -130.02 136.64 49.62 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.074 0.464 . . . . 0.0 111.688 -174.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -107.69 130.61 54.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 172.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.453 HD12 ' CZ ' ' A' ' 65' ' ' PHE . 7.8 tt -109.27 129.46 63.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-O 121.255 0.55 . . . . 0.0 112.267 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -112.7 122.21 47.01 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.188 172.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.465 ' SD ' ' CH2' ' A' ' 18' ' ' TRP . 61.1 mtt -101.16 133.09 46.23 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -110.62 131.65 54.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.653 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -77.5 -46.68 21.7 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 169.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -134.49 131.24 37.8 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.167 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . 0.453 ' HA3' HD13 ' A' ' 62' ' ' LEU . . . -120.26 56.95 0.59 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.99 -173.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.5 m -63.93 -51.17 65.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.284 0.564 . . . . 0.0 109.571 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -83.44 29.69 0.5 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.451 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.64 -49.14 77.44 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.943 0.402 . . . . 0.0 111.706 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -74.7 -23.7 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.951 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -68.43 -52.66 30.22 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.987 0.422 . . . . 0.0 109.895 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.609 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.0 tt -64.85 -40.92 90.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.279 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -58.61 -44.5 89.94 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.92 0.391 . . . . 0.0 110.119 177.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.35 -43.79 83.75 Favored 'General case' 0 C--O 1.239 0.553 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.92 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -63.54 -36.58 84.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.105 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.6 mt -66.31 -45.37 80.56 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.906 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.9 m -78.52 -12.1 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.367 -178.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.3 t -62.6 2.13 0.31 Allowed 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.493 ' HG2' HD11 ' A' ' 80' ' ' ILE . 3.7 mp0 -106.85 131.72 53.63 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 122.08 -0.387 . . . . 0.0 111.568 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -66.22 -18.07 65.12 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.909 170.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 24.2 mmm180 -58.5 -13.61 5.98 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.565 174.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 127' ' ' ARG . 49.5 t 78.25 143.7 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.891 0.744 . . . . 0.0 110.824 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.19 99.02 0.62 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.79 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.649 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 5.9 mm-40 -83.34 111.83 19.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 174.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 50.1 t -98.2 121.92 49.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.262 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 p -132.02 122.08 24.93 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.738 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.458 ' CD2' ' HG2' ' A' ' 64' ' ' MET . 21.8 mt -87.56 127.67 35.26 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.522 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 39.9 mm-40 -90.88 102.62 15.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.265 0.555 . . . . 0.0 110.096 176.301 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 151.98 -178.57 29.16 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.982 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -73.0 99.02 2.63 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 84.2 mtp -70.23 99.29 1.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.441 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.479 ' CG ' ' HD3' ' A' ' 139' ' ' PRO . 26.7 p90 -61.03 -29.21 5.07 Favored Pre-proline 0 CA--C 1.548 0.895 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 178.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.479 ' HD3' ' CG ' ' A' ' 138' ' ' TYR . 31.4 Cg_exo -63.39 -7.22 11.77 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 121.773 1.649 . . . . 0.0 112.688 172.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -149.14 -97.11 0.17 Allowed Glycine 0 C--N 1.333 0.376 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 120.866 0.365 . . . . 0.0 110.421 177.541 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.996 0 N-CA-C 112.227 -0.349 . . . . 0.0 112.227 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -120.66 157.32 29.84 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.358 0.263 . . . . 0.0 110.303 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.1 tt -113.22 -13.21 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-O 120.919 0.39 . . . . 0.0 111.22 -176.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -58.51 -34.04 70.51 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -51.33 -50.87 58.61 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.276 0.56 . . . . 0.0 110.092 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -48.28 82.39 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.16 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 11' ' ' MET . 30.1 m-80 -51.73 -66.77 0.33 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.397 -176.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.59 -59.8 4.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.01 -64.76 0.84 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.945 0.403 . . . . 0.0 111.703 -173.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -64.95 -48.88 72.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.315 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' ' HE1' ' A' ' 65' ' ' PHE . 4.3 mmt -65.19 -44.72 87.49 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.897 -175.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.65 -51.07 66.78 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.802 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -62.59 -31.86 72.76 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.63 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.0 tp -76.41 -53.26 8.39 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.844 0.354 . . . . 0.0 111.181 177.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.652 HD12 ' SD ' ' A' ' 63' ' ' MET . 4.3 mm? -68.79 -17.41 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.046 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -60.11 -35.19 74.7 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.013 0.435 . . . . 0.0 109.873 174.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -62.42 -50.04 73.09 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.59 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 33.3 m95 -54.38 -42.71 70.68 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.797 -178.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -56.57 -54.44 45.86 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 173.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.616 ' O ' HG13 ' A' ' 24' ' ' ILE . 77.5 tttt -56.73 -35.65 68.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.358 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -64.01 -55.66 20.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.81 0.338 . . . . 0.0 111.136 -178.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -74.28 -22.52 59.26 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.572 -175.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.517 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 27.6 m-20 -75.59 -28.45 58.93 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 172.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.616 HG13 ' O ' ' A' ' 20' ' ' LYS . 63.6 mt -68.2 -32.62 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.03 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -65.58 -35.85 82.03 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.718 172.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.517 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 31.5 mm-40 -55.83 -16.83 5.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.006 0.431 . . . . 0.0 110.683 169.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.05 14.15 55.14 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.001 171.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -138.55 146.54 42.01 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.43 HD13 HG12 ' A' ' 24' ' ' ILE . 3.3 mm? . . . . . 0 C--O 1.236 0.375 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.819 -176.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.1 mt . . . . . 0 C--O 1.237 0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.652 ' SD ' HD12 ' A' ' 15' ' ' LEU . 44.9 mtm -140.09 110.23 6.54 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 174.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.656 ' HG2' HD23 ' A' ' 133' ' ' LEU . 63.0 mtt -110.3 133.04 53.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.401 -171.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.595 ' HE1' ' SD ' ' A' ' 11' ' ' MET . 68.0 m-85 -95.28 134.36 38.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 168.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 20.7 t -126.62 106.95 16.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.486 HG23 ' HB2' ' A' ' 130' ' ' GLU . 3.0 t -91.44 110.69 22.0 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.15 -60.86 2.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.068 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 10.8 m -71.76 -44.6 63.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.705 -173.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.678 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 69.08 2.96 34.38 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.238 -0.506 . . . . 0.0 111.852 -172.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.515 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 53.3 t30 -126.25 132.26 24.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.516 ' O ' ' HB3' ' A' ' 102' ' ' SER . 10.4 Cg_endo -50.79 -16.52 2.45 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 123.556 2.837 . . . . 0.0 113.941 -179.113 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.8 p -64.74 90.96 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.988 0.423 . . . . 0.0 110.615 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -53.76 -30.57 45.03 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.015 -177.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -40.4 -46.35 2.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.469 0.708 . . . . 0.0 112.515 -178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.437 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 60.8 mm-40 -63.28 -49.95 72.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.455 -177.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.478 ' HA ' HG22 ' A' ' 80' ' ' ILE . 91.8 m -62.82 -34.78 78.03 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.763 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.96 -51.87 67.43 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.501 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.39 -47.21 80.06 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.293 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.542 HD12 HD12 ' A' ' 83' ' ' LEU . 10.9 tp -65.28 -41.78 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.029 -0.269 . . . . 0.0 110.927 -177.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.0 m -64.73 -34.05 77.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.935 0.398 . . . . 0.0 110.409 177.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 t -60.39 -44.48 95.63 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.542 HD12 HD12 ' A' ' 80' ' ' ILE . 84.2 mt -59.01 -44.42 91.69 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.018 175.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -56.64 -38.88 72.75 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.752 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -63.96 -56.34 15.87 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.72 -15.65 13.51 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.624 -0.717 . . . . 0.0 114.02 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.3 m -96.37 -65.24 0.98 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.574 0.687 . . . . 0.0 111.337 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.38 -51.57 68.94 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.353 -175.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -72.77 -20.16 61.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -67.54 -36.2 80.53 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 172.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.8 1.72 48.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.408 175.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 67.7 31.53 5.93 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.408 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -77.76 100.74 6.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.159 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -77.38 89.66 3.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.404 0.621 . . . . 0.0 110.617 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.1 m -119.52 157.32 21.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.241 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.59 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.8 tp60 -101.92 103.92 14.6 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.561 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -107.94 135.79 48.73 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.919 -177.981 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.404 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 17.4 m-85 -120.71 121.28 37.92 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.0 tt -92.18 88.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 122.139 0.971 . . . . 0.0 109.268 174.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.28 134.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 177.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 99.9 103.06 2.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -166.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.516 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 16.4 m -37.3 -51.32 1.06 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -171.139 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.678 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.2 p-10 -101.05 -4.78 26.76 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.795 0.331 . . . . 0.0 111.441 -177.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -113.44 126.18 55.05 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.33 -168.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -115.24 130.77 57.0 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 170.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.46 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.9 tt -108.74 146.43 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.832 0.349 . . . . 0.0 111.445 -178.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -132.65 126.96 33.84 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.908 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.481 ' HG3' ' HG2' ' A' ' 63' ' ' MET . 3.6 mpp? -115.35 122.58 46.31 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 174.229 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 109' ' ' LEU . 5.7 mp -109.14 139.63 43.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.566 -178.232 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -104.2 5.93 35.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.27 0.557 . . . . 0.0 109.782 174.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -137.45 146.73 44.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.388 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -125.01 20.66 6.68 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.36 -174.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.6 m -76.74 -46.38 25.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.411 0.624 . . . . 0.0 110.127 179.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -105.48 22.44 15.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.076 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.29 -49.15 78.75 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.163 0.506 . . . . 0.0 111.611 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -23.83 56.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.115 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.33 -45.21 60.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.643 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.4 tt -66.26 -39.89 85.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -57.6 -41.01 80.36 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.122 0.487 . . . . 0.0 109.981 173.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.471 ' HA ' HG22 ' A' ' 123' ' ' VAL . 31.2 t70 -63.54 -41.15 98.47 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.587 178.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -62.51 -36.4 82.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.064 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 92.7 mt -66.43 -49.73 65.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.863 178.109 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.471 HG22 ' HA ' ' A' ' 120' ' ' ASP . 19.3 m -72.05 -13.44 16.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.932 0.396 . . . . 0.0 110.905 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 25.2 t -69.85 2.2 3.64 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.708 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -88.23 92.31 9.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.394 0.616 . . . . 0.0 110.192 -178.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -49.28 -40.96 36.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.72 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.45 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 98.1 mtt180 -56.6 -48.23 77.88 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 127' ' ' ARG . 51.3 t 165.8 138.12 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.461 0.475 . . . . 0.0 110.191 -174.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 179.54 110.69 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.495 0.497 . . . . 0.0 110.935 175.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLU . . . . . 0.486 ' HB2' HG23 ' A' ' 67' ' ' THR . 35.9 mt-10 -108.02 116.76 32.55 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 172.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.54 138.25 39.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.871 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.5 m -149.31 153.54 37.64 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.656 HD23 ' HG2' ' A' ' 64' ' ' MET . 70.7 mt -85.92 156.02 20.68 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.647 0.26 . . . . 0.0 110.465 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.586 ' HG2' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -72.38 148.54 45.16 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 175.375 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 77.08 -81.71 1.16 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.238 -0.506 . . . . 0.0 112.791 176.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -141.83 143.8 33.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.944 0.402 . . . . 0.0 110.879 -176.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' MET . . . . . 0.582 ' HG3' ' HD2' ' A' ' 139' ' ' PRO . 14.0 tpt -90.53 115.99 28.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.382 177.073 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.648 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 98.9 m-85 -56.15 -52.77 70.12 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.648 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 32.5 Cg_exo -58.45 94.72 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.005 1.803 . . . . 0.0 111.982 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 99.94 26.44 8.44 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.488 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 84.0 tttt . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 120.685 0.279 . . . . 0.0 110.739 177.143 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.827 0 N-CA-C 112.106 -0.398 . . . . 0.0 112.106 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -127.35 -174.79 3.26 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 110.422 177.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.611 HG12 ' HB3' ' A' ' 6' ' ' TYR . 14.0 tt -107.02 23.5 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.95 0.881 . . . . 0.0 109.414 177.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -65.97 -16.89 64.29 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.426 -174.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -57.39 -46.34 83.54 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.611 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.7 OUTLIER -62.6 -47.13 85.15 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.025 174.75 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.419 ' O ' ' HB2' ' A' ' 11' ' ' MET . 4.2 m-20 -54.0 -68.05 0.21 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -178.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -50.02 -64.59 0.76 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.255 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 13' ' ' ARG . . . -57.56 -62.53 1.72 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.277 -172.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 16.6 t70 -64.09 -63.39 1.17 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.56 -174.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 14.0 mmt -54.75 -55.75 26.57 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.815 0.34 . . . . 0.0 110.846 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.09 -53.78 10.2 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.3 -173.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 9' ' ' ALA . 35.5 mtt180 -80.13 -8.2 59.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.746 -167.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.534 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 52.5 tp -98.96 -52.98 3.4 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 171.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.26 -11.4 60.9 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.584 0.23 . . . . 0.0 111.358 -175.38 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -48.47 -48.94 37.42 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.18 171.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 20.5 pt20 -57.43 -38.16 73.95 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.382 -175.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -64.63 -39.22 93.32 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.948 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.77 -47.38 85.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.3 ttpm? -63.32 -33.28 75.17 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.214 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -63.67 -48.37 77.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 109.946 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.77 -37.82 71.62 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.672 175.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 72.7 m-20 -68.43 -40.33 81.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.407 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.8 mt -62.51 -38.37 81.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 CA-C-O 121.363 0.601 . . . . 0.0 109.662 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -70.91 -28.69 64.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.237 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 10.0 tp10 -64.29 -12.07 38.05 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.127 172.047 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.13 21.87 34.27 Favored Glycine 0 C--N 1.333 0.381 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.687 173.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -152.03 153.06 33.24 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.184 0.516 . . . . 0.0 111.469 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.168 175.213 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 133' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 121.416 0.627 . . . . 0.0 112.468 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.589 ' HB2' ' HB3' ' A' ' 134' ' ' GLU . 35.3 mtp -126.74 148.67 49.87 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.54 ' HE1' ' O ' ' A' ' 115' ' ' ALA . 62.4 mtt -130.79 118.79 21.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -175.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.469 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 25.1 m-85 -98.95 97.41 8.58 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 171.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.538 HG21 HD13 ' A' ' 122' ' ' LEU . 22.0 t -88.76 110.42 21.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.876 0.369 . . . . 0.0 111.466 -172.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.0 m -74.24 96.04 2.73 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.72 HG11 HG21 ' A' ' 80' ' ' ILE . 46.3 t -90.42 -48.46 14.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.314 0.578 . . . . 0.0 110.775 -174.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.836 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 43.7 t -90.97 -61.04 1.75 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.22 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 75.91 -3.2 52.09 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -168.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASN . . . . . 0.403 ' ND2' ' HD2' ' A' ' 72' ' ' PRO . 17.4 t-20 -119.78 134.38 23.91 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 109.695 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.403 ' HD2' ' ND2' ' A' ' 71' ' ' ASN . 19.5 Cg_endo -57.16 -17.74 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.66 2.906 . . . . 0.0 114.832 -173.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.517 HG22 ' HD3' ' A' ' 75' ' ' LYS . 1.1 m -78.21 145.39 35.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.311 0.505 . . . . 0.0 110.343 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -85.27 -22.68 28.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -163.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.521 ' H ' ' HD3' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.06 -42.04 17.98 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.503 0.668 . . . . 0.0 110.706 -173.877 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -65.62 0.57 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.419 -175.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.417 HG21 ' HA ' ' A' ' 102' ' ' SER . 15.3 t -63.73 -37.13 86.19 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.784 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.24 -58.31 9.08 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.136 0.493 . . . . 0.0 110.524 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -60.69 -46.82 88.91 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.433 -177.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.72 HG21 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -68.16 -40.18 82.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.406 -175.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 97.4 m -64.96 -35.96 82.87 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.1 t -62.22 -42.61 99.46 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.983 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.99 -49.02 79.14 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.194 0.521 . . . . 0.0 110.673 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.424 ' HZ3' ' HB3' ' A' ' 105' ' ' ALA . 43.4 m0 -61.16 -41.01 96.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.144 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -55.49 -46.05 76.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 109.881 172.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -68.5 -22.37 74.94 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.747 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 m -96.28 -68.25 0.81 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.924 0.392 . . . . 0.0 111.858 -179.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 88' ' ' LEU . 7.3 mp -63.88 -45.89 87.36 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.85 -172.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -76.82 -0.39 23.78 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.769 0.318 . . . . 0.0 111.542 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -88.29 -36.09 16.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.28 -10.34 59.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.699 171.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 57.7 71.4 0.58 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.636 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -89.17 161.18 16.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.734 175.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -87.32 27.11 1.11 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.058 -177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.579 HG12 ' HG ' ' A' ' 109' ' ' LEU . 29.5 m -86.53 132.94 31.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.298 0.571 . . . . 0.0 111.219 -176.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -99.95 118.71 36.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 173.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.759 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -127.13 140.86 51.96 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.832 -172.106 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -125.77 147.03 49.52 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.492 176.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.4 tt -112.76 98.36 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.538 0.685 . . . . 0.0 109.638 177.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.8 p -149.16 138.66 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.669 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 77.97 102.46 0.19 Allowed Glycine 0 C--O 1.226 -0.363 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.417 ' HA ' HG21 ' A' ' 77' ' ' THR . 14.0 m -49.32 -32.37 11.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -173.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.836 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 10.3 p-10 -74.48 -16.81 60.84 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -177.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 53.9 mtt85 -134.44 156.4 48.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.88 0.848 . . . . 0.0 112.922 -169.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.424 ' HB3' ' HZ3' ' A' ' 84' ' ' TRP . . . -135.77 142.29 44.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 107.703 163.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 4.4 tt -117.15 137.39 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.54 -172.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -131.69 142.27 49.78 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.6 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.444 ' HG2' ' HE3' ' A' ' 63' ' ' MET . 70.6 mtp -127.51 119.65 26.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 177.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.579 ' HG ' HG12 ' A' ' 95' ' ' VAL . 5.0 mp -98.91 119.89 38.43 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.37 -32.65 58.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 175.122 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -112.64 111.55 22.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.593 169.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -85.3 22.94 8.99 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.309 -0.472 . . . . 0.0 112.642 -178.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -60.57 -49.06 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.993 0.425 . . . . 0.0 110.874 -179.144 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.405 ' O ' HG22 ' A' ' 118' ' ' ILE . 40.2 p90 -97.36 29.96 3.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.735 -178.005 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.54 ' O ' ' HE1' ' A' ' 64' ' ' MET . . . -56.12 -53.01 62.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.732 -178.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -75.54 -22.02 57.41 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.17 -177.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -68.3 -56.04 10.0 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 175.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.661 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.4 tt -59.47 -41.55 84.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.796 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.499 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 65.7 tttm -55.06 -48.58 73.29 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.917 0.389 . . . . 0.0 110.337 177.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.04 -46.64 85.02 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.277 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -61.84 -41.29 97.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.47 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 78.7 mt -61.58 -41.2 97.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.664 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 27.7 m -87.29 -4.83 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.575 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.3 m -70.48 2.4 4.0 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.51 0.324 . . . . 0.0 111.736 174.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.526 ' NE2' HG12 ' A' ' 80' ' ' ILE . 46.2 mt-30 -59.69 162.93 4.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.404 0.621 . . . . 0.0 111.777 -177.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -85.97 -42.76 13.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.091 -0.959 . . . . 0.0 108.789 176.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -71.04 -22.82 62.09 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.478 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.3 m 72.86 137.39 0.05 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.919 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -137.72 156.08 48.39 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.542 -178.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -109.24 130.48 55.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.007 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.442 HG22 HG13 ' A' ' 66' ' ' VAL . 58.2 t -109.22 124.36 65.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.896 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.469 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 40.3 p -102.93 137.38 41.21 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 174.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 62' ' ' LEU . 50.1 mt -102.22 149.77 23.97 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.421 -172.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.589 ' HB3' ' HB2' ' A' ' 63' ' ' MET . 3.2 tm-20 -104.65 133.64 49.16 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 114.24 177.77 19.1 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -71.73 120.3 17.13 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 11.0 tpt -56.35 111.26 0.93 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.932 0.396 . . . . 0.0 110.671 -177.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.466 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 43.9 m-85 -74.27 -49.95 5.15 Favored Pre-proline 0 CA--C 1.538 0.516 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.485 -175.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.466 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 92.3 Cg_endo -78.53 171.29 17.02 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.811 1.674 . . . . 0.0 112.08 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -63.26 -56.0 22.69 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 121.148 -0.549 . . . . 0.0 112.208 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.234 0.263 0 C-N-CA 122.568 0.347 . . . . 0.0 110.184 178.32 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.916 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.457 ' HB3' ' HG3' ' A' ' 4' ' ' ARG . 7.0 m-20 -114.01 152.44 30.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.138 0.494 . . . . 0.0 111.026 -176.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 3' ' ' ILE . 12.7 tt -119.15 11.32 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.887 -178.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.457 ' HG3' ' HB3' ' A' ' 2' ' ' ASP . 51.4 mtt180 -58.86 -49.72 76.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.93 -173.023 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -58.52 -42.69 88.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.469 -176.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.29 -48.83 80.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.077 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.621 ' HA ' ' SD ' ' A' ' 11' ' ' MET . 21.9 m-80 -60.38 -69.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.982 -179.097 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -49.53 -66.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.17 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.71 -60.37 3.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.914 -172.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -70.7 -44.54 66.72 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.155 0.502 . . . . 0.0 110.788 -169.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.621 ' SD ' ' HA ' ' A' ' 7' ' ' ASN . 71.0 mtp -74.51 -34.71 63.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.749 -172.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.54 -34.55 76.04 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.859 173.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 -62.8 -39.24 93.66 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.756 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.406 ' CD1' HD22 ' A' ' 15' ' ' LEU . 2.9 pp -84.05 -32.04 25.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.035 179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 11' ' ' MET . 3.5 mm? -69.28 -22.6 63.8 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.773 0.321 . . . . 0.0 110.273 174.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -48.8 -39.38 25.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.289 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -60.16 -46.32 90.07 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.347 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.484 ' CH2' ' HG3' ' A' ' 108' ' ' MET . 57.9 m95 -60.79 -42.14 96.98 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.179 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.06 -47.36 86.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.566 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.5 tttt -62.99 -34.21 77.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.51 178.169 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.19 -54.22 48.45 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.453 0.168 . . . . 0.0 111.117 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.5 p-10 -70.65 -26.71 63.58 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.093 -178.241 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 11.5 m-20 -62.3 -48.43 79.91 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.071 0.462 . . . . 0.0 110.472 172.069 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 20' ' ' LYS . 80.7 mt -59.66 -40.39 82.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.753 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -67.53 -30.73 70.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.399 178.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 74.3 mm-40 -60.43 -15.37 25.82 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 110.447 171.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.22 34.65 6.63 Favored Glycine 0 C--N 1.333 0.377 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.414 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -158.66 149.76 20.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.758 0.313 . . . . 0.0 110.247 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.437 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 63' ' ' MET . . . . . 0.402 ' SD ' HD12 ' A' ' 15' ' ' LEU . 32.5 mtm -132.45 128.71 38.06 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 169.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 60.2 mtt -110.48 122.43 47.7 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.929 0.395 . . . . 0.0 112.049 -171.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -95.62 106.68 18.8 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 169.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.407 HG21 HD13 ' A' ' 122' ' ' LEU . 23.3 t -99.67 112.83 33.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.67 0.272 . . . . 0.0 110.768 -174.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.81 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 25.8 m -85.48 109.66 18.64 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.616 HG11 HG21 ' A' ' 80' ' ' ILE . 42.7 t -94.66 -62.97 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 111.641 -171.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 52.8 p -93.6 -48.06 6.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.201 -173.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 77.66 9.24 87.01 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -165.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -126.22 129.22 24.27 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 123.618 0.767 . . . . 0.0 109.342 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.477 ' O ' ' HB3' ' A' ' 102' ' ' SER . 47.8 Cg_endo -65.64 -18.45 58.87 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.18 2.587 . . . . 0.0 114.816 -169.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.442 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.7 m -63.93 123.69 19.61 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.216 0.462 . . . . 0.0 110.944 -175.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -50.66 -29.04 10.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.759 0.824 . . . . 0.0 112.711 -175.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HG3' HG22 ' A' ' 73' ' ' THR . 25.2 mtpp -38.06 -60.74 0.72 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.447 0.699 . . . . 0.0 112.702 -176.077 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.98 -59.07 6.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.738 -171.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.6 t -60.65 -43.03 98.09 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 123.119 0.262 . . . . 0.0 110.999 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.83 -61.91 2.26 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.957 0.408 . . . . 0.0 111.081 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.1 -50.22 74.22 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.053 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.616 HG21 HG11 ' A' ' 68' ' ' VAL . 7.5 tp -64.45 -41.81 93.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.673 -173.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -66.34 -34.37 77.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.692 0.282 . . . . 0.0 110.652 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 85' ' ' GLN . 22.7 t -60.8 -43.45 98.14 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.331 0.586 . . . . 0.0 109.545 174.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.2 mt -64.29 -37.25 86.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.161 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TRP . . . . . 0.586 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 46.3 m0 -67.11 -29.28 68.98 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.419 178.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.501 ' HB3' ' O ' ' A' ' 82' ' ' SER . 30.8 tt0 -62.51 -55.21 29.67 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.2 -26.95 51.31 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.429 -0.805 . . . . 0.0 113.432 175.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.3 m -86.87 -70.39 0.61 Allowed 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.387 -0.478 . . . . 0.0 111.411 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -53.6 -50.2 66.14 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -173.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.44 ' CD2' ' HA ' ' A' ' 85' ' ' GLN . 57.0 m-85 -77.25 -24.15 51.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -170.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -82.38 -19.97 38.11 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.73 10.41 7.65 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.565 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 74.79 15.1 3.23 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.729 0.812 . . . . 0.0 112.486 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -89.79 153.88 20.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -149.19 77.44 1.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.579 0.704 . . . . 0.0 110.039 176.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 29.4 m -89.36 176.59 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.831 174.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.813 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 5.8 tp60 -100.3 133.77 44.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 173.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.61 ' H ' ' HD3' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.04 133.28 35.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.93 -164.524 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.417 ' O ' HG22 ' A' ' 106' ' ' ILE . 77.4 m-85 -137.85 132.66 32.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 176.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -89.14 88.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.816 0.817 . . . . 0.0 109.298 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -136.96 137.9 46.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.777 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.96 102.09 1.13 Allowed Glycine 0 C--O 1.222 -0.618 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -166.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 15.5 m -46.9 -36.11 7.2 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.444 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 16.9 p-10 -101.18 9.84 41.48 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.81 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 86.3 mtt85 -142.96 159.87 41.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.635 0.731 . . . . 0.0 112.34 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.53 144.69 51.57 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.0 168.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.417 HG22 ' O ' ' A' ' 98' ' ' PHE . 13.2 tt -114.76 141.64 30.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 120.999 0.428 . . . . 0.0 111.189 -177.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -135.21 106.87 6.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.165 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.813 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.3 OUTLIER -93.47 121.6 35.03 Favored 'General case' 0 C--O 1.243 0.752 0 CA-C-O 121.339 0.59 . . . . 0.0 110.118 176.12 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.443 HD12 ' N ' ' A' ' 109' ' ' LEU . 5.5 mp -105.45 120.98 42.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.153 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -54.66 15.61 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -112.51 111.4 22.2 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.42 174.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.27 56.6 4.77 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.249 -0.5 . . . . 0.0 113.183 -175.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.6 m -69.05 -29.38 67.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.868 0.366 . . . . 0.0 111.162 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -124.6 29.32 6.3 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.27 0.557 . . . . 0.0 110.905 -177.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.72 -43.11 90.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.716 -178.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' TRP . . . . . 0.415 ' CH2' ' HG3' ' A' ' 139' ' ' PRO . 16.6 m95 -72.55 -34.43 67.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.724 -175.13 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.88 -51.29 65.27 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.506 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.554 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.1 tt -63.09 -38.64 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 178.242 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 23.2 ttpp -53.04 -57.99 8.5 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.126 0.488 . . . . 0.0 110.623 176.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.691 ' HA ' HG22 ' A' ' 123' ' ' VAL . 33.2 m-20 -68.18 -26.56 65.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.211 -176.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -65.21 -43.07 92.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.8 mt -72.69 -37.75 67.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.61 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' HA ' ' A' ' 120' ' ' ASP . 14.1 m -73.37 -26.03 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.803 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 18.7 t -85.61 3.69 39.66 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.74 176.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.586 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 6.3 tp-100 -65.54 158.64 26.49 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.937 -170.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.7 -68.7 0.28 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.722 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -73.09 4.86 3.87 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.553 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.5 m 71.42 149.54 0.09 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.317 0.647 . . . . 0.0 111.398 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 68' ' ' VAL . . . -171.05 103.76 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.402 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -91.27 130.92 37.08 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.301 0.572 . . . . 0.0 110.515 -179.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 45.5 t -92.01 144.26 9.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.443 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 85.9 m -124.99 136.11 53.42 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 90.6 mt -96.51 125.87 41.3 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 110.573 -174.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -94.89 148.71 22.02 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.52 -115.66 5.27 Favored Glycine 0 N--CA 1.452 -0.268 0 N-CA-C 111.726 -0.55 . . . . 0.0 111.726 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -135.78 124.82 24.31 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 87.7 mtp -76.66 97.96 4.59 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.519 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 49.8 p90 -72.86 -31.71 1.58 Allowed Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 97.0 Cg_endo -76.5 164.65 30.3 Favored 'Trans proline' 0 C--N 1.366 1.471 0 C-N-CA 121.248 1.298 . . . . 0.0 111.814 176.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 107.23 90.65 2.16 Favored Glycine 0 C--N 1.329 0.16 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.57 177.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.438 ' NZ ' ' HB2' ' A' ' 141' ' ' LYS . 4.5 ttmp? . . . . . 0 C--O 1.235 0.336 0 CA-C-O 120.697 0.284 . . . . 0.0 110.31 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.455 HD13 ' HB2' ' A' ' 103' ' ' ASP . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -54.57 -22.68 13.92 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.684 0.278 . . . . 0.0 111.625 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.36 -45.14 88.81 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.518 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -67.95 -40.66 83.2 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.676 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.559 ' O ' ' HB2' ' A' ' 11' ' ' MET . 81.0 m-20 -51.12 -69.05 0.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.641 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -53.49 -64.23 0.89 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.295 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.56 -58.69 4.26 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.302 -172.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.506 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 5.8 m-20 -70.17 -34.69 73.3 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -171.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.559 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 29.8 mmt -68.96 -41.55 77.84 Favored 'General case' 0 C--O 1.227 -0.132 0 C-N-CA 119.691 -0.804 . . . . 0.0 109.243 176.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.05 -49.75 68.29 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -66.49 -39.56 88.8 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.298 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.497 HD21 ' HD2' ' A' ' 98' ' ' PHE . 57.4 tp -66.9 -51.46 55.07 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.877 0.37 . . . . 0.0 110.891 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.542 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -69.99 -29.48 66.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.259 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.29 -34.98 66.98 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.061 0.458 . . . . 0.0 110.169 177.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -62.19 -53.02 61.23 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.89 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -57.74 -36.14 71.67 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.987 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -61.5 -50.04 74.3 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.513 ' O ' HG13 ' A' ' 24' ' ' ILE . 31.8 ttmt -65.4 -35.24 80.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.343 -177.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -66.22 -44.93 82.42 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.867 0.365 . . . . 0.0 110.043 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -61.63 -33.5 74.05 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.894 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.27 -42.1 72.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.952 175.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 20' ' ' LYS . 71.5 mt -61.11 -36.6 73.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -70.09 -35.1 73.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.482 175.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.88 -24.63 66.1 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.26 24.36 22.14 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.458 -0.792 . . . . 0.0 114.042 174.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -159.17 156.8 29.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 117.062 0.431 . . . . 0.0 110.454 172.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.371 -178.164 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.4 mt . . . . . 0 N--CA 1.468 0.443 0 CA-C-O 121.385 0.612 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.542 ' SD ' HD12 ' A' ' 15' ' ' LEU . 55.1 mtm -138.12 145.34 41.51 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 170.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.544 ' HG2' HD23 ' A' ' 133' ' ' LEU . 64.3 mtt -128.37 134.2 48.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.886 0.374 . . . . 0.0 111.829 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 134' ' ' GLU . 43.7 m-85 -98.03 121.65 40.21 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 166.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 39.3 t -116.38 104.16 16.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.595 0.236 . . . . 0.0 110.777 -174.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.473 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 86.9 m -72.41 107.66 5.1 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 174.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.757 HG11 HG21 ' A' ' 80' ' ' ILE . 42.3 t -101.09 -62.92 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.718 0.294 . . . . 0.0 111.204 -173.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.7 m -92.62 -45.81 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.867 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.66 10.69 67.71 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.799 -0.921 . . . . 0.0 110.799 -169.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.488 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 30.3 t30 -126.11 129.23 24.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 123.615 0.766 . . . . 0.0 109.096 -177.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.488 ' HD2' ' OD1' ' A' ' 71' ' ' ASN . 13.8 Cg_endo -55.15 -18.15 17.02 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.549 2.833 . . . . 0.0 114.225 -176.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 75' ' ' LYS . 24.4 m -58.77 93.06 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.919 0.39 . . . . 0.0 111.611 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.461 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 2.6 mp0 -50.81 -23.66 2.92 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.289 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.58 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -59.61 -41.22 89.88 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.757 -174.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.26 -53.53 55.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.679 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.519 ' HA ' HG22 ' A' ' 80' ' ' ILE . 17.5 m -62.77 -32.88 74.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.54 -60.09 4.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.316 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 42.0 mt-10 -55.71 -55.82 27.71 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.575 0.703 . . . . 0.0 110.867 -178.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.757 HG21 HG11 ' A' ' 68' ' ' VAL . 10.7 tp -65.1 -48.93 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.073 -171.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.489 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 89.8 m -63.56 -29.83 71.03 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 122.244 -0.285 . . . . 0.0 110.662 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.3 t -59.41 -46.68 88.04 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.512 HD12 HD12 ' A' ' 80' ' ' ILE . 55.6 mt -58.39 -48.48 80.48 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.092 175.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.512 ' NE1' HG13 ' A' ' 80' ' ' ILE . 28.7 m0 -59.27 -39.45 82.93 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.098 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.5 mt-30 -64.68 -58.06 7.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -53.42 -22.26 15.38 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-N 115.71 -0.677 . . . . 0.0 113.91 176.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -88.39 -61.72 1.65 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 117.453 0.627 . . . . 0.0 111.306 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.58 -47.51 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.808 -173.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.416 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 71.3 m-85 -78.69 1.12 24.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.276 -176.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 48.8 t30 -89.34 -37.6 14.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 177.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.44 2.36 48.03 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.637 176.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.4 t30 60.87 89.32 0.08 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.268 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -114.93 140.44 49.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.531 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.66 66.67 1.08 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 110.408 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.9 m -134.71 163.51 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.832 -177.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -139.96 148.83 42.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 173.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.609 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -133.76 137.58 45.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.523 0.202 . . . . 0.0 110.591 -173.531 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.497 ' HD2' HD21 ' A' ' 14' ' ' LEU . 22.9 m-85 -124.77 136.28 53.72 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.3 tt -109.04 89.95 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.463 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.3 p -132.07 125.37 54.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.254 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.518 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 70.91 100.99 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.126 -174.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.461 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 3.0 m -56.61 -14.88 3.56 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -173.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.455 ' HB2' HD13 ' A' ' 3' ' ' ILE . 19.7 t70 -57.57 -51.36 69.78 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 46.2 mtt180 -134.36 132.39 39.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.614 -174.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -96.21 136.95 35.99 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 168.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.628 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.9 tt -105.62 136.95 37.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.131 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.434 ' CZ ' ' HE3' ' A' ' 84' ' ' TRP . 25.3 m-85 -132.09 116.98 17.73 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.022 -176.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.628 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.1 mpp? -100.45 121.03 40.88 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.451 ' N ' HD12 ' A' ' 109' ' ' LEU . 4.9 mp -104.31 119.74 39.64 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.455 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 19.0 mmm-85 -82.36 -16.17 50.15 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -126.72 126.35 43.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.613 174.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.73 10.53 59.04 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 121.137 -0.554 . . . . 0.0 113.502 -175.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.1 m -63.72 -50.53 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.247 0.524 . . . . 0.0 110.319 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -91.93 24.59 3.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.681 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.28 -53.95 52.43 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.087 0.47 . . . . 0.0 111.313 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -71.71 -17.08 62.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.824 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -74.91 -49.96 18.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.241 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 5.1 tt -62.97 -44.91 99.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -55.15 -45.43 75.68 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.478 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.47 -42.95 93.21 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.351 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.01 -39.27 89.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.623 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 33.5 mt -68.51 -38.12 80.64 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.175 -178.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 18.8 m -84.28 -16.88 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.24 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.1 t -75.53 1.57 13.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.399 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -87.71 160.54 18.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.875 0.369 . . . . 0.0 111.53 -173.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -52.48 -66.8 0.32 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.427 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -71.94 -21.37 61.62 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.894 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.8 m 68.68 134.14 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.167 0.587 . . . . 0.0 111.581 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.441 ' HB3' ' HB3' ' A' ' 122' ' ' LEU . . . -100.65 147.56 25.84 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.423 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.473 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 38.7 mt-10 -99.83 117.72 34.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.113 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 29.9 t -110.01 134.15 53.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.384 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 24.1 p -137.72 145.73 42.88 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.544 HD23 ' HG2' ' A' ' 64' ' ' MET . 79.1 mt -86.51 158.9 19.45 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.636 0.255 . . . . 0.0 110.654 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER . . . . . 0 CA--C 1.535 0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.93 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.792 HG12 ' HB3' ' A' ' 6' ' ' TYR . 13.6 tt . . . . . 0 CA--C 1.542 0.651 0 CA-C-O 122.028 0.918 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.518 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 72.0 ttt-85 -63.75 -24.11 67.63 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.006 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.21 -42.55 99.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.362 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.792 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -57.94 -47.06 84.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.374 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.527 ' O ' ' HB2' ' A' ' 11' ' ' MET . 22.2 m-80 -47.52 -70.63 0.09 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.311 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.56 -61.95 2.13 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.996 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -57.24 -68.94 0.18 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.466 -174.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 4.5 m-20 -61.3 -48.69 80.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.257 -0.402 . . . . 0.0 112.07 -173.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.536 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 7.5 mmt -59.67 -46.38 89.22 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.273 -175.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.22 80.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.006 0.431 . . . . 0.0 111.251 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 86.8 mtt180 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.255 -174.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 15' ' ' LEU . 4.4 pp -89.25 -29.57 19.13 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.369 175.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.1 OUTLIER -63.71 -30.94 71.98 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 175.469 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -48.16 -42.06 28.54 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.914 177.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -62.1 -52.54 63.45 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.403 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.522 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 48.0 m95 -62.35 -39.4 92.98 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.376 -176.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.69 -48.22 80.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.654 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.535 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.3 tttt -62.11 -48.0 82.13 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.032 -178.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -44.93 86.93 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.132 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -57.6 -45.14 85.66 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.073 0.463 . . . . 0.0 110.04 176.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -62.2 -41.52 98.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.954 177.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 20' ' ' LYS . 91.1 mt -60.59 -40.86 85.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.196 0.522 . . . . 0.0 109.999 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -67.19 -31.61 72.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.813 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.33 -10.65 17.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.324 0.583 . . . . 0.0 110.198 172.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.93 33.02 7.57 Favored Glycine 0 CA--C 1.518 0.227 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.991 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -159.46 147.23 17.27 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 171.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.8 mm? . . . . . 0 C--O 1.235 0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.013 -175.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.626 HD11 HD22 ' A' ' 133' ' ' LEU . 44.2 tp . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.498 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 79.8 mtp -135.08 135.11 40.98 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 166.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.527 ' SD ' HD11 ' A' ' 109' ' ' LEU . 86.9 mtp -115.84 119.38 35.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.845 0.355 . . . . 0.0 111.397 -171.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 49.6 m-85 -95.16 123.18 38.52 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.454 HG21 HD13 ' A' ' 122' ' ' LEU . 43.2 t -124.04 109.06 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 117.794 0.27 . . . . 0.0 110.939 -173.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.466 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 28.3 m -74.0 98.49 3.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.641 HG11 HG21 ' A' ' 80' ' ' ILE . 11.4 t -87.63 -58.42 3.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.296 -171.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.614 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 34.7 t -89.92 -58.87 2.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.993 -174.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 88.41 -10.76 70.27 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.559 HD21 HG23 ' A' ' 73' ' ' THR . 11.4 t30 -122.98 132.62 24.27 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.938 0.495 . . . . 0.0 109.7 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 49.4 Cg_exo -56.99 -16.17 19.76 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.139 3.226 . . . . 0.0 115.639 -172.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.559 HG23 HD21 ' A' ' 71' ' ' ASN . 18.8 p -52.26 110.68 0.52 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.467 0.576 . . . . 0.0 112.16 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 35.8 mt-10 -55.15 -23.95 23.99 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.715 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -42.39 -62.45 0.96 Allowed 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.006 176.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.408 ' O ' HG22 ' A' ' 80' ' ' ILE . 9.5 mm-40 -56.67 -55.46 33.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.195 -172.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 102' ' ' SER . 11.5 t -63.6 -46.18 86.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.694 -173.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.401 ' N ' HG23 ' A' ' 77' ' ' THR . 37.3 tt0 -61.05 -49.35 77.72 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.886 0.375 . . . . 0.0 110.182 -177.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -62.62 -52.79 61.97 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.475 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.641 HG21 HG11 ' A' ' 68' ' ' VAL . 10.9 tp -67.16 -41.73 87.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.228 -174.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.9 m -66.53 -31.04 71.5 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.673 0.273 . . . . 0.0 110.536 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -63.64 -46.52 85.32 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.8 mt -59.66 -37.5 78.91 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.35 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.552 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 48.6 m0 -64.4 -44.35 91.56 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.484 177.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.51 -59.53 4.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.57 -62.16 4.2 Favored Glycine 0 CA--C 1.522 0.477 0 CA-C-N 115.806 -0.633 . . . . 0.0 113.139 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.1 m -58.84 -57.34 13.47 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.36 -46.69 89.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.929 0.395 . . . . 0.0 111.458 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -72.35 -27.84 62.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.125 -177.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -75.7 -28.19 58.53 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 110.064 177.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 3.63 51.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.287 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.3 t30 62.76 75.94 0.38 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.672 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -107.67 122.17 46.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.086 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -81.24 26.49 0.45 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.227 0.537 . . . . 0.0 110.617 -176.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 m -92.05 157.44 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.906 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -112.85 154.97 25.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.407 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -146.95 138.15 24.05 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.553 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -122.11 151.5 40.85 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.867 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -121.14 90.2 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.636 0.731 . . . . 0.0 110.697 -175.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.9 p -128.82 129.64 68.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 174.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.415 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 80.67 101.32 0.32 Allowed Glycine 0 C--O 1.226 -0.378 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -170.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.5 ' O ' ' HB ' ' A' ' 77' ' ' THR . 15.3 m -62.55 -9.11 7.67 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -169.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.614 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 16.1 p-10 -96.42 -18.98 19.52 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 122.113 -0.367 . . . . 0.0 111.335 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.493 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 49.9 ttt180 -137.88 132.27 32.24 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.983 -172.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.22 153.51 22.04 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.423 HG23 ' HE1' ' A' ' 108' ' ' MET . 11.3 tt -124.93 136.27 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 120.844 0.354 . . . . 0.0 111.269 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 64' ' ' MET . 13.4 m-85 -117.96 139.02 51.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.751 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.522 ' HG2' ' CH2' ' A' ' 18' ' ' TRP . 1.5 mpt? -109.96 115.92 30.67 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.604 178.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.56 HD12 HD23 ' A' ' 62' ' ' LEU . 15.4 mt -126.23 103.4 7.66 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.495 0.497 . . . . 0.0 111.502 -174.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mtp-105 -99.26 5.61 46.57 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 122.076 0.941 . . . . 0.0 108.502 165.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -146.85 124.09 11.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.026 -1.443 . . . . 0.0 107.674 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.63 57.17 0.25 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 119.805 -1.188 . . . . 0.0 113.808 -173.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.4 t -66.36 -25.97 67.05 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -96.79 24.02 6.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.373 177.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.32 -49.94 72.86 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.204 0.526 . . . . 0.0 111.321 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.509 ' HH2' HD11 ' A' ' 133' ' ' LEU . 0.6 OUTLIER -76.62 -26.88 55.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.762 -179.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.06 -48.73 75.1 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 120.886 0.374 . . . . 0.0 110.297 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.62 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 15.0 tt -67.33 -39.02 81.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 177.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -55.13 -46.6 75.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.457 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.5 ' HA ' HG22 ' A' ' 123' ' ' VAL . 37.5 m-20 -61.95 -41.37 97.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.471 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -59.66 -38.44 81.46 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.099 0.476 . . . . 0.0 110.399 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 70.9 mt -69.82 -47.81 61.39 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.5 HG22 ' HA ' ' A' ' 120' ' ' ASP . 24.9 m -73.28 -18.72 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.718 0.294 . . . . 0.0 111.476 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 24.7 t -71.53 0.91 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.498 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.552 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 45.8 mt-30 -76.87 162.85 27.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.74 0.781 . . . . 0.0 112.715 -174.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.65 8.79 1.3 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.345 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 80.9 mtt-85 -121.14 -18.26 7.5 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 122.373 0.269 . . . . 0.0 110.882 -171.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 52.9 t 57.59 71.75 0.56 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.357 0.599 . . . . 0.0 109.984 -172.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.52 130.21 39.6 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.028 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.466 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 42.7 mt-10 -81.26 114.04 19.79 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.252 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.3 t -95.53 128.08 47.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.5 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 33.8 p -133.08 145.28 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.626 HD22 HD11 ' A' ' 62' ' ' LEU . 60.7 mt -102.13 168.87 9.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 110.978 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.557 ' HA ' ' HE2' ' A' ' 65' ' ' PHE . 36.1 tt0 . . . . . 0 C--O 1.234 0.289 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.141 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.502 HD11 ' HA2' ' A' ' 101' ' ' GLY . 12.8 tt . . . . . 0 CA--C 1.537 0.467 0 CA-C-O 121.579 0.704 . . . . 0.0 109.988 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.404 ' HA ' HD22 ' A' ' 7' ' ' ASN . 92.8 mtt180 -57.96 -31.61 67.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.009 -176.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.45 -50.34 71.97 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.976 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.02 -47.17 86.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.993 176.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.58 ' O ' ' HB2' ' A' ' 11' ' ' MET . 91.7 m-20 -52.34 -74.93 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.961 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -51.65 -66.34 0.4 Allowed 'General case' 0 C--O 1.24 0.595 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -57.34 8.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.885 -169.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -76.26 -37.76 57.15 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.111 -168.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.58 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 11.1 mmt -67.79 -40.86 83.88 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 120.156 -0.618 . . . . 0.0 109.728 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.9 -52.28 66.14 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 121.212 0.53 . . . . 0.0 110.158 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.42 -32.37 73.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.858 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.7 tp -77.38 -52.52 9.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.819 0.343 . . . . 0.0 110.801 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.407 ' N ' HD22 ' A' ' 15' ' ' LEU . 3.5 mm? -77.05 -10.23 59.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.995 -177.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -47.98 -53.78 15.0 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.996 175.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.18 -37.73 88.53 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.254 -177.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -61.22 -42.17 98.13 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.028 0.442 . . . . 0.0 110.764 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -69.52 -41.24 76.29 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.498 ' O ' HG13 ' A' ' 24' ' ' ILE . 59.1 tttp -54.15 -50.36 67.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.093 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.2 -54.39 47.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.01 178.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.95 -41.71 64.76 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.176 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -65.93 -44.97 83.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.644 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.4 mt -61.98 -34.69 64.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 120.856 0.36 . . . . 0.0 110.39 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -69.13 -38.74 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.308 177.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.49 -21.32 66.25 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.369 0.604 . . . . 0.0 109.658 170.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.98 17.78 46.22 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.304 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -113.8 109.14 18.07 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 176.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.455 HD13 HG12 ' A' ' 24' ' ' ILE . 3.8 mm? . . . . . 0 C--N 1.329 -0.298 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 175.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 109' ' ' LEU . 1.5 tm? . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 121.378 0.609 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.474 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 8.8 ptm -147.19 113.58 5.94 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.225 174.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.574 ' HE2' HD21 ' A' ' 62' ' ' LEU . 62.5 mtt -117.42 141.29 48.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.815 -170.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.481 ' HE2' ' HG2' ' A' ' 134' ' ' GLU . 51.9 m-85 -107.03 122.08 45.75 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 168.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 t -110.62 102.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 110.933 -174.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.726 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 37.1 m -77.15 100.34 5.72 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 172.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.467 HG11 HG21 ' A' ' 80' ' ' ILE . 50.4 t -80.34 -63.64 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.153 -171.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.534 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 38.7 t -93.24 -55.39 3.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.127 0.489 . . . . 0.0 112.233 -172.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.612 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 90.86 -10.27 75.39 Favored Glycine 0 N--CA 1.451 -0.329 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 -167.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.505 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 34.6 t30 -107.79 126.61 29.46 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 176.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.567 ' O ' ' HB2' ' A' ' 102' ' ' SER . 19.0 Cg_endo -56.62 -16.45 19.12 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.6 2.867 . . . . 0.0 114.42 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.681 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.1 m -61.66 95.61 0.05 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.291 0.567 . . . . 0.0 110.468 -177.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -44.94 -31.01 1.12 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.571 1.148 . . . . 0.0 113.918 -172.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.681 ' HG3' HG22 ' A' ' 73' ' ' THR . 0.0 OUTLIER -51.76 -34.61 40.2 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -175.598 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.612 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 5.6 mm-40 -58.23 -55.66 32.17 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.02 0.438 . . . . 0.0 111.023 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.6 m -65.21 -34.73 79.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.923 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.62 -51.65 68.48 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.722 0.296 . . . . 0.0 110.341 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 50.3 mt-10 -55.79 -54.11 48.47 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.33 0.586 . . . . 0.0 110.079 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.488 HD12 HD12 ' A' ' 83' ' ' LEU . 2.6 tp -62.15 -42.36 94.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.146 -172.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 72.6 m -64.67 -39.2 93.27 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.629 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.2 m -62.66 -40.28 96.56 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 120.838 0.351 . . . . 0.0 110.339 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.488 HD12 HD12 ' A' ' 80' ' ' ILE . 86.6 mt -60.89 -50.09 74.81 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.686 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.9 m0 -60.61 -31.7 70.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.036 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.582 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 35.3 tt0 -62.75 -63.36 1.24 Allowed 'General case' 0 C--O 1.235 0.327 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 173.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.49 -13.68 24.22 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.634 -0.712 . . . . 0.0 114.025 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -96.55 -71.36 0.68 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.376 0.588 . . . . 0.0 111.743 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 9.4 mp -56.42 -54.96 39.48 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.342 -174.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.582 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 91.8 m-85 -72.02 -14.32 61.85 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.358 -173.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -78.62 -32.7 47.58 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.46 11.74 22.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.672 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 72.65 25.7 2.56 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.359 0.664 . . . . 0.0 112.638 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 27.7 m-85 -81.99 81.77 7.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.64 82.49 3.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.239 0.542 . . . . 0.0 109.922 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.839 HG12 HD21 ' A' ' 109' ' ' LEU . 4.3 m -109.14 165.56 5.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.365 -177.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -101.5 136.54 41.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 174.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.623 ' HD3' ' N ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.33 142.22 23.83 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -172.805 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -127.27 127.74 44.86 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.6 tt -87.4 88.0 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 122.071 0.939 . . . . 0.0 109.125 173.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.78 134.58 38.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.119 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.502 ' HA2' HD11 ' A' ' 3' ' ' ILE . . . 100.4 104.7 2.67 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.567 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 11.1 p -38.23 -51.92 1.47 Allowed 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -173.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.612 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 10.1 p-10 -102.11 8.16 40.83 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.726 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 54.4 mtt180 -137.04 140.8 42.31 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.58 143.85 46.5 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.641 173.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.645 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.7 tt -112.34 139.56 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.741 0.305 . . . . 0.0 111.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -128.77 139.85 52.0 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.781 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.645 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.3 mpp? -135.14 143.19 46.4 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.049 0.452 . . . . 0.0 110.517 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.839 HD21 HG12 ' A' ' 95' ' ' VAL . 12.4 mt -138.44 151.98 47.92 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.366 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 110' ' ' ARG . 7.3 mmm180 -85.35 -33.02 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.589 176.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -112.73 152.9 28.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.163 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -118.34 27.39 7.33 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 121.273 -0.489 . . . . 0.0 112.474 -178.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -66.02 -69.25 0.31 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.019 0.438 . . . . 0.0 110.693 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.02 25.71 1.1 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.329 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.76 92.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.824 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -77.52 -31.29 53.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.362 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -67.45 -50.84 57.44 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.215 177.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 7.6 tt -62.72 -37.9 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.344 -0.389 . . . . 0.0 109.985 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.478 ' HD3' ' N ' ' A' ' 120' ' ' ASP . 12.2 tmtt? -56.48 -51.64 67.69 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.293 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.482 ' HA ' HG22 ' A' ' 123' ' ' VAL . 64.9 m-20 -62.15 -33.37 74.37 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.668 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -67.58 -42.79 81.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 94.5 mt -61.08 -41.65 97.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.482 HG22 ' HA ' ' A' ' 120' ' ' ASP . 20.6 m -79.06 -15.91 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.515 0.197 . . . . 0.0 111.246 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.5 t -64.87 2.17 0.76 Allowed 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.686 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -84.87 98.84 10.55 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.349 0.595 . . . . 0.0 110.174 -176.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -45.97 -51.24 13.73 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.467 -1.242 . . . . 0.0 113.582 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 30.9 mtm180 -55.79 -44.65 77.97 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.71 0.29 . . . . 0.0 111.482 -174.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 69' ' ' SER . 21.5 p 177.07 136.0 0.06 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.779 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 125' ' ' GLN . . . -170.93 116.98 0.46 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.75 0.309 . . . . 0.0 111.171 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -137.03 127.61 26.89 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 10.8 p -123.9 143.97 35.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 0.0 110.773 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 53.6 m -131.53 144.98 51.52 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 177.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.449 HD23 ' HG2' ' A' ' 64' ' ' MET . 64.1 mt -93.58 145.5 24.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.481 ' HG2' ' HE2' ' A' ' 65' ' ' PHE . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.626 HG21 ' HB3' ' A' ' 103' ' ' ASP . 12.1 tt . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 121.61 0.719 . . . . 0.0 110.657 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 60.7 mtt85 -109.58 -37.13 5.78 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.499 -175.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -56.31 -43.58 79.06 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.736 -178.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.448 ' HE1' HG13 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -55.21 -47.11 75.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.441 176.731 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.606 ' O ' ' HB2' ' A' ' 11' ' ' MET . 44.1 m-80 -60.88 -64.54 0.92 Allowed 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -50.36 -69.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.683 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.45 ' HB1' ' NH1' ' A' ' 13' ' ' ARG . . . -59.38 -64.4 0.96 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.042 -174.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.73 -46.49 65.81 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.863 -167.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.606 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 22.3 mmt -70.54 -38.51 74.22 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.938 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.32 -47.12 77.66 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.417 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.45 ' NH1' ' HB1' ' A' ' 9' ' ' ALA . 80.3 mtt180 -70.3 -26.79 63.95 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.885 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.6 tp -82.77 -52.28 6.9 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.907 176.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 4.1 mm? -73.1 -17.25 61.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.986 -174.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.5 OUTLIER -57.47 -32.97 67.5 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.102 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.96 -45.76 84.39 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.806 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -63.29 -41.21 98.96 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.912 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 46.5 mt-10 -63.02 -43.13 99.59 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.394 0.616 . . . . 0.0 109.381 176.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 24' ' ' ILE . 26.4 ttpt -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.12 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -59.07 -44.93 91.92 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.319 0.58 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.5 -37.24 86.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.32 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.33 -37.53 80.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.945 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 20' ' ' LYS . 85.8 mt -62.17 -38.53 81.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 174.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.87 -36.34 82.97 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.898 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -63.02 -15.07 55.17 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.738 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.99 24.77 26.4 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.682 177.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -134.7 132.0 38.33 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.406 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.5 mm? . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.574 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 C--O 1.235 0.302 0 CA-C-O 121.208 0.528 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 21.4 ptm -132.03 110.23 10.58 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.675 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 56.8 mtt -114.73 122.15 45.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.721 -169.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -88.38 117.83 27.57 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 168.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.532 HG21 HD13 ' A' ' 122' ' ' LEU . 39.5 t -114.43 104.75 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.588 0.232 . . . . 0.0 110.954 -173.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.732 HG23 ' HB2' ' A' ' 130' ' ' GLU . 1.6 t -84.96 122.37 29.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -85.35 -61.58 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.302 -174.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 30.9 t -92.88 -36.38 12.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.145 0.498 . . . . 0.0 111.127 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.94 7.52 77.61 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -168.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.456 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 7.7 t30 -126.63 139.98 36.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 114.66 -0.77 . . . . 0.0 109.802 -176.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -47.51 -16.23 0.41 Allowed 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.632 3.555 . . . . 0.0 116.586 -174.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.456 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 5.5 p -76.73 160.28 29.46 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.501 1.046 . . . . 0.0 110.869 -169.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.605 ' HG2' ' HG3' ' A' ' 78' ' ' GLU . 37.5 tt0 -104.08 -25.38 12.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.646 -166.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.754 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.58 -52.74 53.75 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.678 -171.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -45.37 -58.89 2.99 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.283 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.473 ' HA ' HG22 ' A' ' 80' ' ' ILE . 35.5 m -67.13 -35.97 80.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.856 -174.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.605 ' HG3' ' HG2' ' A' ' 74' ' ' GLU . 49.1 mt-10 -56.05 -60.17 3.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.09 176.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.431 ' O ' HD13 ' A' ' 83' ' ' LEU . 44.0 mt-10 -59.08 -54.02 51.82 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.899 -175.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.823 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.9 tp -62.36 -42.76 96.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.938 -174.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 91.7 m -64.0 -33.18 75.15 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.457 0.17 . . . . 0.0 111.063 176.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.1 m -63.04 -39.07 93.65 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 110.294 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 79' ' ' GLU . 10.4 mp -67.75 -48.28 66.86 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.539 174.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.717 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 43.7 m0 -55.87 -55.94 26.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.968 -179.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -57.33 -54.81 42.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.61 -29.16 3.93 Favored Glycine 0 C--N 1.333 0.393 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.273 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.6 m -91.79 -57.1 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 117.527 0.664 . . . . 0.0 111.284 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.88 -48.62 79.3 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.667 -174.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -74.31 -22.49 59.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.979 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -73.62 -29.41 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.15 0.5 51.51 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.128 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 66.43 36.59 5.06 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.193 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -81.47 119.75 24.13 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -84.75 49.94 1.81 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.245 0.545 . . . . 0.0 111.199 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.99 150.21 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.433 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -102.49 144.98 30.23 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.489 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -146.42 137.92 24.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.147 -177.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -127.45 123.14 35.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 175.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -93.74 88.12 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.997 0.903 . . . . 0.0 109.337 173.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.448 HG13 ' HE1' ' A' ' 6' ' ' TYR . 7.0 p -131.53 143.39 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.093 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.2 85.74 0.14 Allowed Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.9 m -30.21 -44.27 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -167.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.626 ' HB3' HG21 ' A' ' 3' ' ' ILE . 13.2 t70 -69.18 -32.81 72.38 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -172.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 93.0 mtt180 -122.46 134.17 54.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.296 0.57 . . . . 0.0 112.323 -171.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -102.65 132.68 48.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 170.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.532 HD12 ' SD ' ' A' ' 11' ' ' MET . 9.3 tt -104.65 129.68 56.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.041 0.448 . . . . 0.0 111.197 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -115.2 132.38 56.63 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.613 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -131.27 136.52 48.25 Favored 'General case' 0 C--O 1.244 0.798 0 CA-C-O 121.366 0.603 . . . . 0.0 110.993 177.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.491 HD21 HD12 ' A' ' 118' ' ' ILE . 4.6 mp -123.11 156.13 35.59 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.871 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -105.09 5.72 32.65 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -135.35 151.75 50.8 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.493 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -127.58 41.53 1.58 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.054 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.8 m -93.6 -65.53 0.99 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.055 0.455 . . . . 0.0 110.113 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 41.4 p90 -91.0 27.6 1.79 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.021 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.61 -48.1 73.4 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.74 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -30.88 69.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.202 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.426 ' HB3' ' O ' ' A' ' 114' ' ' TYR . 5.1 tp10 -52.91 -49.71 65.39 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 172.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.619 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 25.1 mt -64.46 -45.41 95.86 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.126 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -58.17 7.32 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.317 0.58 . . . . 0.0 110.072 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.508 ' O ' ' HB2' ' A' ' 124' ' ' SER . 11.2 m-20 -61.38 -36.85 81.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.791 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -63.36 -47.16 83.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.738 0.304 . . . . 0.0 110.381 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.5 mt -57.81 -45.9 85.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.815 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.525 HG12 ' O ' ' A' ' 129' ' ' ALA . 13.1 m -84.97 -6.75 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -177.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 23.2 t -68.65 0.99 3.54 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.823 ' HG2' HD11 ' A' ' 80' ' ' ILE . 2.9 mp0 -96.04 155.7 16.65 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.602 -0.686 . . . . 0.0 110.633 -174.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -51.59 -51.68 53.56 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.873 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -67.18 -10.12 47.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.483 179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 63.4 m 66.08 -156.62 0.26 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.906 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.525 ' O ' HG12 ' A' ' 123' ' ' VAL . . . 173.23 126.77 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.732 ' HB2' HG23 ' A' ' 67' ' ' THR . 46.0 mt-10 -96.97 113.66 25.21 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.339 0.59 . . . . 0.0 110.331 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.9 t -98.99 135.94 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.282 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.4 m -127.1 112.75 15.54 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.675 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.6 mp -89.95 128.03 36.15 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 . . . . . 0 C--N 1.325 -0.46 0 CA-C-O 120.866 0.365 . . . . 0.0 110.109 176.982 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.4 tt . . . . . 0 C--O 1.236 0.374 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -52.25 -36.41 52.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.304 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.6 -49.9 75.8 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.008 0.433 . . . . 0.0 110.4 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.4 -48.09 76.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.662 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.08 -62.01 1.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.635 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -57.71 -56.91 15.77 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.281 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.93 -61.48 2.58 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.586 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.91 -54.87 41.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.162 -174.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.471 ' O ' HD23 ' A' ' 15' ' ' LEU . 6.2 mmt -58.01 -52.39 65.72 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-O 120.599 0.238 . . . . 0.0 110.904 -176.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.55 -50.18 74.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.019 0.438 . . . . 0.0 111.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -77.41 -12.11 59.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.142 -0.481 . . . . 0.0 112.095 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.2 tp -79.96 -52.15 8.2 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.387 0.613 . . . . 0.0 109.572 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.7 -15.31 62.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.72 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.49 -43.41 45.26 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.572 0.701 . . . . 0.0 109.724 171.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.76 -45.65 93.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.454 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.449 ' CZ3' ' HG3' ' A' ' 108' ' ' MET . 28.4 m95 -62.26 -37.43 85.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -60.49 -43.5 96.94 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.053 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.9 tttt -61.43 -50.76 71.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.458 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.11 -46.71 79.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.792 0.329 . . . . 0.0 111.469 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -57.44 -48.69 78.48 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.369 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 28.9 t70 -71.62 -28.88 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 20' ' ' LYS . 50.4 mt -64.42 -42.51 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -69.98 -26.95 64.33 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.03 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.423 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 8.4 tp10 -60.44 -18.32 50.3 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.642 0.734 . . . . 0.0 109.264 169.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.14 35.26 6.38 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.84 172.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -156.48 141.84 17.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.408 ' N ' HD12 ' A' ' 29' ' ' LEU . 7.0 mp . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.492 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 109' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 121.238 0.542 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.764 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 28.9 mtp -138.74 132.17 30.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.723 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 63.4 mtt -116.88 125.21 51.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.225 0.536 . . . . 0.0 112.147 -170.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.581 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 72.2 m-85 -95.17 121.63 37.01 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 168.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.511 HG21 HD13 ' A' ' 122' ' ' LEU . 40.6 t -117.02 105.59 18.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.755 0.312 . . . . 0.0 110.614 -174.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.2 m -79.37 98.42 6.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.496 HG11 HG21 ' A' ' 80' ' ' ILE . 25.2 t -79.64 -60.33 2.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.727 -172.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' A' ' 71' ' ' ASN . 39.9 t -92.62 -57.03 2.8 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.015 -173.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.735 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 82.12 11.52 82.29 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 -167.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.538 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 8.4 t30 -125.99 136.07 27.96 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 123.15 0.58 . . . . 0.0 109.709 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -59.99 -16.89 41.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.886 3.057 . . . . 0.0 116.382 -168.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.538 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 2.7 p -69.65 172.18 7.85 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.27 0.941 . . . . 0.0 112.144 -173.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.91 -22.62 14.29 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.41 -167.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.607 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 10.8 mptt -60.65 -51.89 67.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.601 -170.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.522 ' HG2' ' H ' ' A' ' 77' ' ' THR . 1.6 pm0 -47.57 -62.58 1.37 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.721 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.522 ' H ' ' HG2' ' A' ' 76' ' ' GLU . 14.2 t -60.96 -43.9 98.06 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.48 0.181 . . . . 0.0 110.904 -174.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -57.4 -60.87 3.0 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.165 0.507 . . . . 0.0 110.881 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 37.6 mt-10 -67.73 -37.85 82.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.701 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.496 HG21 HG11 ' A' ' 68' ' ' VAL . 9.8 tp -70.09 -39.76 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.444 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.5 m -64.87 -38.03 89.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.608 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.4 p -67.47 -34.86 78.03 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.701 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 92.5 mt -64.6 -48.85 73.38 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.965 0.412 . . . . 0.0 110.074 174.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 m0 -58.18 -39.9 80.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.803 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -57.15 -58.82 6.54 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.57 -28.07 36.15 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 115.439 -0.8 . . . . 0.0 113.804 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.7 m -85.15 -69.3 0.66 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 117.395 0.597 . . . . 0.0 111.805 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.5 mp -59.95 -35.09 74.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -172.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -85.67 -2.58 58.33 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -103.85 -26.27 12.75 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 171.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.85 -11.25 59.94 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.308 0.575 . . . . 0.0 109.461 168.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 66.56 78.74 0.25 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.647 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -117.13 170.65 8.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.667 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -125.86 98.22 5.44 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.426 HG12 ' CD2' ' A' ' 109' ' ' LEU . 30.9 m -139.02 153.7 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.756 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.446 ' HB3' ' SD ' ' A' ' 108' ' ' MET . 6.6 tp60 -101.56 145.57 28.85 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 169.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.64 ' HD3' ' N ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -148.79 132.84 17.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.618 -169.771 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -129.96 132.88 46.47 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.141 175.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.495 HD11 HG23 ' A' ' 77' ' ' THR . 8.6 tt -91.31 89.03 2.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.704 0.764 . . . . 0.0 109.677 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.4 125.62 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.056 -178.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 101.0 104.6 2.72 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -167.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.446 ' O ' ' HB ' ' A' ' 77' ' ' THR . 16.0 m -47.93 -34.03 8.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.575 0.584 . . . . 0.0 112.575 -175.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.735 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 7.1 p-10 -103.22 -4.19 24.69 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -135.67 136.34 40.85 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.919 0.39 . . . . 0.0 111.789 -164.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.2 154.68 30.71 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.003 175.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.7 tt -123.41 139.05 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.412 178.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -131.41 154.32 48.77 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.114 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 18' ' ' TRP . 0.8 OUTLIER -148.38 135.32 20.07 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.357 0.599 . . . . 0.0 111.821 176.265 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.426 ' CD2' HG12 ' A' ' 95' ' ' VAL . 13.2 mt -108.93 109.33 20.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.589 174.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.72 -27.06 31.42 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 175.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -147.38 111.61 5.18 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.925 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.52 129.32 1.34 Allowed Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.756 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.3 m -95.25 -19.75 19.76 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 111.043 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -75.64 35.9 0.13 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.962 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.0 -56.44 21.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.877 -177.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.426 ' HA ' ' HB3' ' A' ' 119' ' ' LYS . 0.7 OUTLIER -73.96 -14.42 61.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.522 -176.684 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -75.55 -52.47 10.55 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.9 tt -62.38 -39.35 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.723 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 51.9 tttm -54.71 -51.67 64.86 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.511 174.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.49 -43.86 76.0 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.561 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -66.74 -39.76 88.06 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 98.7 mt -65.5 -39.97 92.5 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.046 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 30.0 m -89.41 -2.66 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 120.821 0.343 . . . . 0.0 111.081 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.2 t -61.99 2.16 0.24 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -87.3 104.25 16.23 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.429 0.633 . . . . 0.0 110.347 -174.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -48.31 -44.81 34.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.328 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -69.23 -44.82 71.23 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.449 ' O ' ' HB3' ' A' ' 129' ' ' ALA . 23.5 t -166.75 -152.95 0.14 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.631 -171.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 128' ' ' CYS . . . 84.25 109.23 0.06 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.048 0.939 . . . . 0.0 111.921 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -124.28 141.43 52.07 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.422 175.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 14.8 p -118.83 149.71 21.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.023 0.44 . . . . 0.0 111.474 -174.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.3 m -143.18 146.83 34.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 86.4 mt -86.85 162.32 17.83 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.838 0.352 . . . . 0.0 111.222 -175.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.764 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 1.6 tm-20 . . . . . 0 C--O 1.234 0.286 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.893 177.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 50.6 mm . . . . . 0 CA--C 1.531 0.239 0 CA-C-O 120.792 0.329 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.3 mtm105 -61.15 -50.16 74.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.506 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.98 -49.76 74.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.336 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -58.78 -46.92 86.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.15 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.419 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.2 m-80 -53.19 -71.56 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.173 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -53.6 -61.86 2.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.197 -176.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.405 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.4 -63.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.663 -172.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.58 -43.53 89.46 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.795 -170.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.419 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 35.3 mtp -72.88 -32.5 65.43 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.055 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.32 88.99 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 172.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 94.7 mtt180 -69.23 -18.85 63.93 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.881 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 66.2 tp -79.52 -52.84 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 110.168 175.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 15' ' ' LEU . 3.9 mm? -71.95 -9.37 58.26 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.781 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -48.25 -40.48 24.76 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.64 0.733 . . . . 0.0 109.159 168.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 51.2 tp60 -61.49 -50.06 74.25 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.442 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.433 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 13.8 m95 -59.73 -35.13 73.93 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.485 -177.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -60.95 -46.19 91.71 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -59.08 -44.17 91.88 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.976 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -59.32 -55.09 39.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.718 0.294 . . . . 0.0 110.632 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.2 -37.72 78.13 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.92 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.08 -50.43 73.3 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.59 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.513 HG12 HD13 ' A' ' 29' ' ' LEU . 77.2 mt -58.57 -39.46 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-O 121.134 0.493 . . . . 0.0 110.248 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.7 -35.15 79.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -78.41 -1.21 32.43 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.13 27.46 37.02 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.38 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -126.75 109.94 12.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.617 0.246 . . . . 0.0 110.392 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.513 HD13 HG12 ' A' ' 24' ' ' ILE . 3.5 mm? . . . . . 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.7 tt . . . . . 0 C--O 1.238 0.474 0 CA-C-O 121.841 0.829 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.424 ' HG2' ' HA ' ' A' ' 108' ' ' MET . 67.4 mtp -141.02 144.33 34.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.631 172.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.2 mtt -118.42 122.43 42.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.86 0.362 . . . . 0.0 111.385 -176.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.522 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 52.2 m-85 -98.47 95.38 7.28 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.9 t -87.83 146.43 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 122.244 -0.285 . . . . 0.0 110.327 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.476 ' HB ' ' NH2' ' A' ' 104' ' ' ARG . 7.2 t -125.26 110.37 13.96 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 174.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.527 HG11 HG21 ' A' ' 80' ' ' ILE . 21.4 t -98.44 -60.94 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.355 -169.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -83.34 -50.08 8.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.862 -170.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.8 20.34 74.2 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -168.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -126.35 136.97 29.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 114.743 -0.729 . . . . 0.0 109.125 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -64.05 -15.79 51.26 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.32 2.68 . . . . 0.0 114.693 -172.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.615 HG22 ' HD3' ' A' ' 75' ' ' LYS . 17.1 m -75.76 119.97 20.5 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.555 0.693 . . . . 0.0 111.26 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -55.58 -23.62 28.18 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.528 0.731 . . . . 0.0 111.557 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.615 ' HD3' HG22 ' A' ' 73' ' ' THR . 11.0 mptt -62.2 -62.83 1.49 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.705 -169.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.452 ' OE1' ' HB ' ' A' ' 73' ' ' THR . 13.8 pm0 -65.95 -37.15 85.27 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.543 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.509 HG23 HD11 ' A' ' 99' ' ' ILE . 12.2 t -68.3 -38.79 82.0 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.638 0.256 . . . . 0.0 110.312 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.83 -46.62 89.84 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 45.7 mt-10 -56.18 -54.24 47.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.134 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.608 HD12 HD12 ' A' ' 83' ' ' LEU . 11.1 tp -63.19 -43.14 98.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-O 120.946 0.403 . . . . 0.0 111.006 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.8 m -66.69 -30.7 71.02 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.065 0.46 . . . . 0.0 110.21 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.7 t -70.68 -33.9 71.4 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.699 177.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.608 HD12 HD12 ' A' ' 80' ' ' ILE . 88.0 mt -63.52 -45.16 91.91 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.254 0.549 . . . . 0.0 109.705 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.684 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.1 m0 -60.85 -44.66 96.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.948 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -57.84 -38.64 76.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.234 0.54 . . . . 0.0 109.982 172.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.18 -31.35 77.28 Favored Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.737 -178.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.4 m -95.99 -60.36 1.65 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.77 -48.05 80.77 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.402 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 64.7 m-85 -69.95 -32.7 71.08 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.739 0.304 . . . . 0.0 110.892 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -67.66 -28.22 67.52 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.237 0.541 . . . . 0.0 109.705 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.85 8.73 11.6 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.366 175.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 68.13 30.17 5.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.094 174.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -89.45 108.36 19.6 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 173.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -80.47 62.74 4.68 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.328 0.585 . . . . 0.0 110.623 178.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.5 m -90.45 167.75 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.113 176.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.749 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.8 tp60 -110.17 143.13 40.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.447 173.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.461 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.86 135.13 35.89 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.726 0.298 . . . . 0.0 110.539 -177.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -131.02 153.45 49.24 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.509 HD11 HG23 ' A' ' 77' ' ' THR . 9.4 tt -130.71 90.04 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.68 0.752 . . . . 0.0 110.745 -179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.2 p -130.57 128.24 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.9 104.01 2.67 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -167.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -46.68 -25.63 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 67' ' ' THR . 12.1 p-10 -100.67 -27.73 13.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.319 0.58 . . . . 0.0 110.209 178.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.476 ' NH2' ' HB ' ' A' ' 67' ' ' THR . 0.2 OUTLIER -84.62 121.57 27.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.764 -171.322 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -116.42 132.42 56.68 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 13.0 tt -124.38 132.25 71.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-O 121.083 0.468 . . . . 0.0 111.44 -173.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -120.74 128.75 53.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.355 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.749 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 1.8 mpt? -99.16 122.33 42.22 Favored 'General case' 0 C--O 1.247 0.971 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.347 177.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.454 ' N ' HD22 ' A' ' 109' ' ' LEU . 2.4 mm? -117.64 121.66 41.48 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 123.839 0.712 . . . . 0.0 109.264 174.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.7 mmm-85 -67.89 -49.11 63.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -128.27 110.99 12.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.769 172.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -89.86 47.01 3.15 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.616 -175.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.2 m -59.56 -39.69 84.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.269 0.557 . . . . 0.0 110.481 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 22.0 p90 -98.34 23.32 8.53 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.154 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.54 97.39 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.509 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -67.71 -34.05 76.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.353 -176.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -59.55 -43.58 93.5 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.102 0.477 . . . . 0.0 109.91 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.559 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -65.39 -42.22 93.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.481 176.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -53.72 -52.06 61.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.225 0.536 . . . . 0.0 110.182 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.447 ' HA ' HG22 ' A' ' 123' ' ' VAL . 1.7 m-20 -62.04 -38.1 87.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.635 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -61.86 -53.68 52.55 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.722 0.296 . . . . 0.0 110.464 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 76.0 mt -50.65 -47.69 58.49 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.419 177.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.447 HG22 ' HA ' ' A' ' 120' ' ' ASP . 19.8 m -80.22 -13.34 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.583 0.23 . . . . 0.0 111.412 -177.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.1 t -73.9 -0.78 17.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.957 0.408 . . . . 0.0 110.558 175.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.684 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 21.3 mt-30 -84.13 165.24 18.63 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -78.79 -47.1 17.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.776 -167.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -86.89 -20.68 27.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.094 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 57.6 m 67.37 175.36 0.26 Allowed 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.433 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -161.24 156.46 24.18 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.96 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -99.74 157.1 16.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.246 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.69 151.66 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.139 0.495 . . . . 0.0 111.221 -174.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.522 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 59.8 m -124.87 134.49 52.68 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 88.9 mt -96.5 142.75 28.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.329 -175.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.963 178.656 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.2 tt . . . . . 0 CA--C 1.537 0.467 0 CA-C-O 122.246 1.022 . . . . 0.0 108.408 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 18.4 ttp180 -63.06 -37.28 86.57 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.382 -1.281 . . . . 0.0 111.651 -175.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 1.1 m-20 -58.19 -46.62 85.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.19 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.554 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.9 OUTLIER -54.32 -47.67 72.23 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 173.342 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.512 ' O ' ' HB2' ' A' ' 11' ' ' MET . 0.8 OUTLIER -50.63 -76.18 0.02 OUTLIER 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.735 -177.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -61.3 -61.94 2.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.14 -176.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 5' ' ' ASP . . . -62.44 -50.64 70.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.949 -169.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.554 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 1.3 m-20 -78.48 -43.57 26.74 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.523 -172.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.528 ' O ' HD23 ' A' ' 15' ' ' LEU . 8.9 mmt -63.12 -43.05 99.49 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.833 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 16' ' ' GLU . . . -64.51 -53.91 40.72 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.902 0.382 . . . . 0.0 110.327 177.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.1 ttp-105 -52.33 -38.75 59.42 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.946 -175.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.6 tp -84.88 -49.16 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.334 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 11' ' ' MET . 4.5 mm? -68.11 -21.43 64.95 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -172.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 29.8 mt-10 -55.64 -25.71 40.58 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.914 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 46.4 tt0 -63.08 -49.74 73.31 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 176.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -64.31 -35.29 80.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.161 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.98 -53.19 61.01 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.517 ' O ' HG13 ' A' ' 24' ' ' ILE . 20.1 ttpp -51.67 -43.11 62.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.791 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -62.21 -52.79 62.36 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.546 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -69.55 -28.24 65.83 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.4 -177.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -65.16 -45.78 83.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.1 0.476 . . . . 0.0 110.397 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 20' ' ' LYS . 68.6 mt -60.75 -43.91 96.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.341 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -66.14 -36.25 82.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -63.75 -26.25 68.56 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.413 0.625 . . . . 0.0 109.763 175.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.97 40.84 4.5 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.518 176.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -147.04 110.3 4.82 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 173.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.236 0.363 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.527 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.402 HD22 HD23 ' A' ' 133' ' ' LEU . 2.5 pp . . . . . 0 C--O 1.243 0.753 0 CA-C-O 122.402 1.096 . . . . 0.0 113.553 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 23.8 ptp -125.69 132.61 52.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 113.709 -1.587 . . . . 0.0 107.99 174.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.457 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 82.8 mtp -108.29 116.91 32.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 -174.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.441 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 56.5 m-85 -89.16 125.51 35.08 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.525 HG11 HD22 ' A' ' 122' ' ' LEU . 22.1 t -115.83 98.3 6.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.756 ' HB ' ' HB3' ' A' ' 130' ' ' GLU . 4.9 m -74.41 94.92 2.63 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 176.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 p -102.11 -47.1 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.096 -169.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 m -91.26 -49.23 6.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.883 0.373 . . . . 0.0 111.569 -172.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 66.99 10.96 57.56 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -170.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 33.2 t30 -127.2 125.72 24.11 Favored Pre-proline 0 CA--C 1.533 0.306 0 C-N-CA 123.229 0.612 . . . . 0.0 109.565 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 25.4 Cg_exo -61.94 -18.3 60.48 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.282 2.655 . . . . 0.0 113.503 -177.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.445 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 37.7 m -55.44 104.15 0.12 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.699 0.4 . . . . 0.0 111.073 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.498 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 42.1 mt-10 -50.05 -25.93 3.88 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.579 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 0.3 OUTLIER -58.49 -37.61 75.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.809 -177.113 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -57.74 -64.79 0.78 Allowed 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.639 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.464 ' HA ' HG22 ' A' ' 80' ' ' ILE . 12.6 t -62.3 -36.13 81.17 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.648 -177.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -53.47 -59.7 4.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.988 0.423 . . . . 0.0 110.922 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.78 -45.74 74.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.373 -175.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.464 HG22 ' HA ' ' A' ' 77' ' ' THR . 10.8 tp -66.92 -42.02 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.164 -175.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 67.8 m -69.86 -33.15 71.87 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.638 0.256 . . . . 0.0 110.447 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.6 t -59.33 -47.53 85.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.114 0.483 . . . . 0.0 109.719 175.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.8 mt -59.78 -48.19 82.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.053 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.582 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 44.1 m0 -58.69 -32.74 69.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.032 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.626 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 29.6 tt0 -66.1 -62.77 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -57.69 -18.12 30.19 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.791 -0.64 . . . . 0.0 114.143 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.3 m -95.88 -65.28 0.98 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 117.498 0.649 . . . . 0.0 111.574 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.33 -52.31 54.76 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.83 0.348 . . . . 0.0 111.34 -173.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.626 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 98.1 m-85 -72.27 -9.13 58.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 0.0 111.156 -176.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 39.2 t30 -72.81 -26.81 61.64 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.51 14.32 17.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.759 177.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 60.11 77.35 0.32 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.037 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -107.33 119.14 38.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.548 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -78.09 69.35 4.29 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.691 0.757 . . . . 0.0 109.768 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.533 HG22 HD13 ' A' ' 109' ' ' LEU . 57.7 t -126.02 136.79 59.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.586 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -101.6 115.46 30.57 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.597 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -107.49 131.93 53.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.243 -175.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.529 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.5 m-30 -110.55 131.09 55.35 Favored 'General case' 0 C--O 1.247 0.962 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.4 tt -111.38 89.69 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.991 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.44 144.39 17.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.68 82.51 0.23 Allowed Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.966 -1.254 . . . . 0.0 109.966 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.498 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 12.6 m -50.13 -23.6 2.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -168.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -61.0 -25.07 66.62 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.678 0.275 . . . . 0.0 110.828 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -145.49 159.62 42.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.612 0.72 . . . . 0.0 112.398 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -122.64 139.54 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.857 -1.065 . . . . 0.0 108.326 168.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.529 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 5.1 tt -110.12 126.3 67.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.588 -177.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.464 ' HB3' HG11 ' A' ' 95' ' ' VAL . 96.8 m-85 -112.25 112.1 23.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.185 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.506 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 68.5 mtm -90.93 122.43 33.61 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.533 HD13 HG22 ' A' ' 95' ' ' VAL . 4.0 mm? -87.61 103.92 16.02 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 123.513 0.508 . . . . 0.0 110.718 -175.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.6 -28.95 56.34 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 172.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -135.2 116.27 14.27 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.677 -1.147 . . . . 0.0 108.644 172.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -103.92 16.52 50.56 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.223 -0.513 . . . . 0.0 114.038 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -60.5 -20.39 59.98 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 117.207 0.504 . . . . 0.0 111.373 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -120.0 24.73 10.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.071 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.87 87.65 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.435 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -79.92 -27.01 39.92 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.02 -178.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.15 -50.47 70.3 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.611 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.0 tt -64.68 -41.47 92.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.129 176.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.448 ' HG3' HG11 ' A' ' 131' ' ' VAL . 86.7 tttt -54.83 -53.01 60.78 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.816 0.341 . . . . 0.0 110.943 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.493 ' HA ' HG22 ' A' ' 123' ' ' VAL . 20.0 m-20 -61.08 -39.14 88.79 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.584 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.433 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 89.7 t80 -60.31 -39.96 88.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.924 0.392 . . . . 0.0 109.988 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.2 mt -66.55 -41.01 89.33 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.375 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 120' ' ' ASP . 18.7 m -75.61 -19.08 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.728 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 54.1 m -82.33 0.05 43.46 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.329 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.582 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 15.1 mm100 -73.77 162.87 28.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.897 0.38 . . . . 0.0 111.036 -177.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -54.31 -64.4 0.84 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.373 -174.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 127' ' ' ARG . 40.7 mtt180 -65.2 -7.6 13.54 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 44.0 t 57.25 79.24 0.2 Allowed 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -172.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.41 140.77 57.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 -171.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.756 ' HB3' ' HB ' ' A' ' 67' ' ' THR . 39.8 tt0 -79.12 118.39 21.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.727 177.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.448 HG11 ' HG3' ' A' ' 119' ' ' LYS . 48.1 t -101.55 130.14 51.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.47 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 20.7 p -135.86 129.33 32.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.457 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.1 mp -112.43 127.23 55.97 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 . . . . . 0 C--N 1.327 -0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.972 177.364 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.429 HG23 ' ND2' ' A' ' 7' ' ' ASN . 15.3 tt . . . . . 0 CA--C 1.548 0.903 0 CA-C-O 122.268 1.032 . . . . 0.0 108.592 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -71.62 -42.1 68.05 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -163.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -51.74 -50.13 61.2 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.886 0.374 . . . . 0.0 110.981 -172.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.485 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -63.29 -41.32 98.96 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.95 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.645 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 14.4 m-80 -55.7 -72.14 0.08 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.05 -63.06 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.344 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.13 -66.29 0.56 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.648 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -69.5 -43.85 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.928 -169.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.645 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 1.3 mmt -70.68 -45.27 65.35 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.778 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.25 97.49 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.511 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -81.24 -12.84 59.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.531 -177.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.525 ' HG ' HD22 ' A' ' 15' ' ' LEU . 5.5 tp -82.17 -54.33 5.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.026 0.441 . . . . 0.0 110.089 169.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.532 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 4.4 mm? -65.59 -25.55 67.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.92 -177.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -51.78 -42.18 62.21 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.325 0.584 . . . . 0.0 109.967 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.55 -48.82 79.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.273 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.506 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 43.6 m95 -58.32 -40.05 81.02 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.877 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 15' ' ' LEU . 41.7 mm-40 -61.36 -49.56 76.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.787 178.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.482 ' O ' HG13 ' A' ' 24' ' ' ILE . 78.9 tttt -60.61 -38.45 84.73 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.937 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -43.1 98.26 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -63.06 -39.82 95.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.303 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -61.43 -45.43 94.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.863 0.364 . . . . 0.0 110.496 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.4 mt -61.35 -36.4 72.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.442 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.1 -45.01 74.92 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -66.9 -17.91 65.13 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.988 176.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.84 48.83 3.29 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.441 173.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -150.29 128.92 12.3 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.422 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.532 0.272 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.157 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.431 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 110.467 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.668 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 15.6 ptm -144.47 112.4 6.3 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.928 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.526 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 65.7 mtt -114.22 122.82 47.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.412 -175.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -93.93 111.14 22.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 171.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 131' ' ' VAL . 30.0 t -112.14 112.29 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 122.241 -0.287 . . . . 0.0 110.96 -172.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.62 HG23 ' HB2' ' A' ' 130' ' ' GLU . 3.8 t -87.56 107.07 18.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.3 m -101.79 -40.04 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.037 -171.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.465 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 36.7 t -86.9 -55.54 3.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.482 -172.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.704 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 78.38 -4.92 57.78 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.525 -171.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -125.87 132.78 24.42 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 123.323 0.649 . . . . 0.0 109.416 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.638 ' O ' ' HB3' ' A' ' 102' ' ' SER . 35.1 Cg_endo -60.13 -16.37 39.45 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.375 2.717 . . . . 0.0 114.389 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.429 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 23.7 m -60.96 100.17 0.11 Allowed 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.933 -0.48 . . . . 0.0 110.116 173.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 1.3 mp0 -57.11 -23.21 45.43 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.404 -174.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.556 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -55.46 -34.73 64.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.361 -173.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.413 ' O ' HD13 ' A' ' 80' ' ' ILE . 34.9 mm-40 -59.26 -50.9 72.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.314 0.578 . . . . 0.0 109.484 176.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.8 m -67.83 -29.73 68.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.815 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.36 -49.86 72.2 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -59.76 -48.37 81.96 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 110.059 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.442 HG13 ' NE2' ' A' ' 125' ' ' GLN . 1.5 mp -53.72 -54.06 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.062 178.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.0 m -62.82 -35.45 79.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.076 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.6 t -63.7 -57.34 10.3 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.925 0.393 . . . . 0.0 110.635 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.86 -44.23 97.24 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.811 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.53 ' CZ3' HD22 ' A' ' 122' ' ' LEU . 45.3 m0 -63.89 -38.73 92.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.532 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -59.91 -60.98 2.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.17 -52.17 13.25 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.968 177.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.1 m -59.3 -54.78 42.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.777 0.323 . . . . 0.0 111.686 -176.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 84' ' ' TRP . 9.7 mp -69.28 -29.15 66.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.405 -175.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -75.66 -30.61 59.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.6 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.35 -30.99 70.94 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.71 4.57 36.07 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.384 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.8 t30 60.91 66.19 0.93 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.146 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -115.57 101.29 8.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.57 173.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.74 73.66 1.54 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.501 0.667 . . . . 0.0 110.621 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.2 m -87.98 157.21 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.528 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.506 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.9 tp60 -110.94 100.93 9.55 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.671 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.3 OUTLIER -109.8 138.81 45.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.575 -174.008 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.416 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 68.3 m-85 -134.98 128.52 32.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.26 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.5 tt -87.87 87.57 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-O 121.926 0.87 . . . . 0.0 108.918 169.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 p -132.35 121.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.485 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 100.8 102.74 2.56 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 -163.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.638 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 41.0 m -37.67 -50.6 1.19 Allowed 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -171.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.704 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.5 p-10 -100.62 7.44 43.98 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -173.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.5 mtt180 -128.5 139.59 52.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.227 0.537 . . . . 0.0 111.809 -173.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.08 128.16 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.05 171.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.416 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 9.8 tt -98.31 123.14 50.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 121.173 0.511 . . . . 0.0 110.641 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -112.59 108.13 17.1 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.848 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.464 ' SD ' HD11 ' A' ' 15' ' ' LEU . 70.5 mtm -108.34 130.67 55.19 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.093 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 65.8 mt -117.88 122.5 43.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.119 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.452 HH11 ' HG3' ' A' ' 110' ' ' ARG . 0.0 OUTLIER -68.49 -49.86 56.56 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.021 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -113.12 111.67 22.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.977 -1.011 . . . . 0.0 108.706 172.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -108.54 43.86 1.62 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.817 -171.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 m -61.55 -31.6 71.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 110.586 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -101.99 21.31 14.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.014 -176.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.92 -54.94 40.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.581 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -31.56 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.984 -174.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -66.02 -39.55 90.32 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.078 0.466 . . . . 0.0 109.755 177.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.571 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.2 mt -60.76 -52.77 57.68 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.195 173.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.22 -48.39 54.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.94 0.4 . . . . 0.0 110.388 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -59.83 -42.82 94.39 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.995 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.57 -50.16 68.37 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.057 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 13.4 mt -57.68 -43.31 84.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.135 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -74.7 -26.9 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 120.995 -0.282 . . . . 0.0 111.572 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -78.62 2.66 18.63 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.255 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.443 ' HG3' ' HE1' ' A' ' 84' ' ' TRP . 1.1 tm0? -74.13 161.27 30.17 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.776 0.322 . . . . 0.0 111.024 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.74 -66.24 0.58 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.696 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.424 ' N ' ' OE1' ' A' ' 125' ' ' GLN . 36.1 mtm180 -69.99 -3.02 14.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.282 176.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.507 ' SG ' ' N ' ' A' ' 129' ' ' ALA . 42.1 t 73.77 176.58 0.25 Allowed 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.212 0.605 . . . . 0.0 111.48 174.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.507 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -169.8 135.24 1.43 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.711 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.62 ' HB2' HG23 ' A' ' 67' ' ' THR . 39.2 mm-40 -102.23 113.64 27.1 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 173.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.425 HG13 HG22 ' A' ' 66' ' ' VAL . 46.1 t -94.16 120.13 43.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 -177.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.6 m -107.79 130.06 55.0 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.526 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.9 mp -106.37 114.54 28.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.668 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 27.0 mm-40 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 -178.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.8 tt . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 122.122 0.963 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.549 ' HA ' ' HB2' ' A' ' 7' ' ' ASN . 12.1 mtp180 -70.69 -17.54 62.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.732 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.403 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 13.2 t70 -54.55 -52.34 62.36 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.513 ' OH ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -66.27 -44.51 83.38 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.17 178.667 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.549 ' HB2' ' HA ' ' A' ' 4' ' ' ARG . 25.3 m-80 -51.3 -78.58 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.239 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.96 -59.88 3.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.788 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.583 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -67.86 -60.6 2.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -171.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.616 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 12.8 t70 -69.66 -39.13 77.25 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.974 -169.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.518 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 2.0 mmt -64.42 -45.5 87.31 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.65 -42.58 71.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.871 0.367 . . . . 0.0 110.218 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.616 ' HD2' ' HA ' ' A' ' 10' ' ' ASP . 81.9 mtt180 -54.09 -62.38 1.69 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.083 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.499 HD12 HD22 ' A' ' 15' ' ' LEU . 3.9 pp -80.33 -18.41 49.24 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -171.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.499 HD22 HD12 ' A' ' 14' ' ' LEU . 3.5 mm? -79.34 -30.49 42.73 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.132 -0.355 . . . . 0.0 110.945 175.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -50.09 -39.02 41.33 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.265 0.555 . . . . 0.0 110.513 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -61.28 -38.93 88.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.238 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.503 ' CZ2' ' HG2' ' A' ' 108' ' ' MET . 61.7 m95 -66.15 -42.48 88.98 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.211 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -62.59 -46.68 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.557 ' O ' HG13 ' A' ' 24' ' ' ILE . 22.9 tttm -51.58 -54.33 28.81 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.729 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.8 -38.88 76.79 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -173.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -60.0 -45.63 92.13 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.396 0.617 . . . . 0.0 109.377 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 36.9 m-20 -66.54 -28.56 68.64 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.4 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 20' ' ' LYS . 60.1 mt -70.83 -42.85 77.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.255 176.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -73.32 -16.97 61.35 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.047 0.451 . . . . 0.0 109.972 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.454 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.5 tp10 -58.89 -15.15 11.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.443 0.64 . . . . 0.0 109.639 168.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.45 28.14 11.99 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.238 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -160.51 158.88 30.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.1 mm? . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.941 -175.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 62.9 mt . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.588 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 21.8 ptp -138.53 114.34 9.93 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.772 171.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 86.0 mtp -108.88 117.81 35.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.535 -173.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.528 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 1.3 m-85 -97.42 121.31 39.17 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.0 t -117.11 105.51 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.787 0.327 . . . . 0.0 110.492 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 10.1 m -78.29 105.84 9.8 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.765 HG11 HG21 ' A' ' 80' ' ' ILE . 41.3 t -88.97 -61.77 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.482 -170.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.515 ' HB2' ' HG3' ' A' ' 76' ' ' GLU . 47.4 t -92.59 -46.46 7.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.332 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.96 2.97 87.74 Favored Glycine 0 CA--C 1.519 0.287 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -168.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.543 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 9.3 t30 -121.81 132.0 24.32 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 102' ' ' SER . 46.5 Cg_endo -63.43 -15.46 48.58 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.59 2.86 . . . . 0.0 116.058 -165.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.543 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 0.9 OUTLIER -71.7 133.01 45.35 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.184 0.902 . . . . 0.0 112.437 -169.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -50.33 -42.14 52.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.386 -1.279 . . . . 0.0 113.589 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.882 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 3.0 mptp? -49.15 -60.84 2.45 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -165.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.515 ' HG3' ' HB2' ' A' ' 69' ' ' SER . 2.1 pm0 -50.81 -60.39 3.11 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.053 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.679 ' HA ' HG22 ' A' ' 80' ' ' ILE . 45.5 m -71.08 -28.36 64.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.841 -174.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.38 -52.24 66.45 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.464 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 43.6 mt-10 -64.97 -48.0 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.243 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.765 HG21 HG11 ' A' ' 68' ' ' VAL . 10.6 tp -62.31 -41.96 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.74 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 96.5 m -67.26 -32.95 74.32 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.862 0.363 . . . . 0.0 110.433 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.2 t -62.47 -40.31 96.22 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.648 HD12 HD12 ' A' ' 80' ' ' ILE . 77.0 mt -62.58 -44.75 95.53 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.527 ' HZ2' HE22 ' A' ' 125' ' ' GLN . 49.0 m0 -57.25 -37.36 72.2 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.601 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.455 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 0.9 OUTLIER -62.3 -61.49 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.732 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.51 -19.84 43.03 Favored Glycine 0 CA--C 1.523 0.542 0 CA-C-N 115.683 -0.689 . . . . 0.0 114.266 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.534 ' HB2' HD12 ' A' ' 88' ' ' LEU . 18.1 m -96.38 -69.33 0.76 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.081 0.44 . . . . 0.0 111.193 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.534 HD12 ' HB2' ' A' ' 87' ' ' SER . 4.7 mp -78.51 -57.46 3.76 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.952 0.406 . . . . 0.0 111.259 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.455 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 94.9 m-85 -68.85 -11.34 60.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.251 -173.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -71.98 -27.04 62.5 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.771 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.96 3.67 22.14 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.038 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 62.99 66.33 0.75 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.625 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -84.46 160.71 20.5 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.154 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -95.37 15.88 18.32 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.094 0.473 . . . . 0.0 110.93 -177.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.3 t -88.17 151.55 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.96 176.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -132.39 140.86 48.65 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.05 159.03 42.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.482 -0.192 . . . . 0.0 110.482 -173.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -138.53 154.84 48.78 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.695 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.3 tt -115.5 89.82 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.011 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -118.42 132.73 67.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 173.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 61.3 82.89 0.07 OUTLIER Glycine 0 C--N 1.332 0.34 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 -166.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.42 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 16.9 m -43.69 -42.15 5.17 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -166.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -52.46 -21.7 3.98 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.513 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 33.0 ttt180 -133.12 133.2 42.61 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 110.741 -175.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.88 134.39 52.13 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.2 tt -108.55 132.74 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.72 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -106.09 123.78 48.55 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.425 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.503 ' HG2' ' CZ2' ' A' ' 18' ' ' TRP . 2.1 mpt? -96.11 114.0 25.66 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 171.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.461 ' N ' HD22 ' A' ' 109' ' ' LEU . 2.2 mm? -101.34 103.81 14.78 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.471 -178.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.8 mmm-85 -76.24 -50.34 14.71 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 166.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -104.37 110.65 22.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.518 172.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -110.68 11.76 30.15 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.358 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.1 t -58.54 -40.19 82.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.103 0.478 . . . . 0.0 110.423 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -97.85 21.35 10.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.536 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.33 -37.65 88.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.057 0.456 . . . . 0.0 110.404 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -22.76 62.36 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.646 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -73.08 -37.42 66.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.449 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 mt -63.09 -47.82 90.74 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.26 173.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -57.46 -41.84 81.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -58.31 -44.93 88.83 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.343 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . 0.412 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 73.1 t80 -64.02 -50.35 68.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.249 177.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 96.4 mt -49.64 -43.91 47.16 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.941 177.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.655 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 28.7 m -84.83 -14.35 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-O 120.971 0.415 . . . . 0.0 111.033 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -80.27 1.1 29.91 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.121 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.527 HE22 ' HZ2' ' A' ' 84' ' ' TRP . 40.9 mt-30 -71.84 165.09 24.83 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.965 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -54.21 -64.99 0.65 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.635 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -101.05 -15.46 17.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.052 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.655 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 48.8 t 70.88 170.11 0.32 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.068 0.547 . . . . 0.0 111.154 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.453 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -135.91 171.19 14.82 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.734 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.567 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 44.3 mt-10 -84.34 115.04 22.29 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.597 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -87.83 132.9 31.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.528 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 9.2 m -131.51 138.17 48.84 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 35.1 mt -122.2 111.91 17.53 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.588 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 28.3 mm-40 . . . . . 0 C--N 1.328 -0.347 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.4 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.697 HG12 ' HB3' ' A' ' 6' ' ' TYR . 9.5 tt . . . . . 0 N--CA 1.475 0.815 0 CA-C-O 121.48 0.657 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -56.01 -34.2 65.59 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.387 -177.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.53 -48.01 69.44 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.556 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.697 ' HB3' HG12 ' A' ' 3' ' ' ILE . 2.8 t80 -57.55 -47.11 82.94 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.402 ' N ' HD22 ' A' ' 7' ' ' ASN . 0.9 OUTLIER -52.78 -68.11 0.2 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.731 -177.367 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -54.63 -67.65 0.25 Allowed 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.343 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.55 -58.67 7.3 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.728 -171.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -66.4 -56.74 9.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.749 -172.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.631 ' SD ' ' HD2' ' A' ' 65' ' ' PHE . 10.5 mmt -59.63 -49.99 75.63 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.793 0.33 . . . . 0.0 110.663 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.13 -51.8 49.54 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.994 0.426 . . . . 0.0 111.291 -175.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.5 mtt180 -82.47 -6.99 59.64 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.993 -170.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -91.7 -52.54 4.71 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 11' ' ' MET . 4.0 mm? -72.65 -15.59 61.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.289 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -48.4 -41.03 27.81 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.859 0.838 . . . . 0.0 109.51 170.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.4 ' HG3' ' HD2' ' A' ' 20' ' ' LYS . 30.1 tt0 -68.19 -40.23 82.28 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.963 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 3.3 m95 -60.49 -41.44 94.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.86 0.362 . . . . 0.0 110.776 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.69 -47.01 88.17 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.559 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.6 tmtt? -52.3 -44.57 65.1 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.443 177.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.403 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 30.5 m-20 -67.18 -45.96 75.4 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.641 0.257 . . . . 0.0 111.393 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -58.32 -41.53 84.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.826 0.346 . . . . 0.0 110.678 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 22.0 m-20 -67.76 -36.1 79.9 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.782 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.8 mt -58.39 -43.42 86.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 175.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -37.59 87.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 37.5 tt0 -56.55 -22.39 32.99 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.91 174.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.73 31.78 14.7 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.27 -0.49 . . . . 0.0 112.34 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -141.22 129.3 22.05 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--O 1.235 0.335 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.53 -179.971 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 109' ' ' LEU . 2.2 tm? . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.509 0.671 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.655 ' SD ' ' HG3' ' A' ' 108' ' ' MET . 50.5 mtm -133.38 136.35 45.24 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 166.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.461 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 60.4 mtt -118.53 117.65 29.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.196 -174.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.631 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 16.6 m-85 -90.06 101.61 14.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 172.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.6 t -92.56 106.7 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.639 0.257 . . . . 0.0 111.264 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.601 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 87.7 m -83.06 108.28 16.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.65 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 42.7 t -100.97 -60.75 2.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.978 0.418 . . . . 0.0 111.523 -174.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.597 ' HB3' ' HB3' ' A' ' 76' ' ' GLU . 77.7 p -92.9 -60.33 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.3 19.99 79.79 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -164.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.483 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 8.8 t30 -127.34 133.18 24.79 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 115.19 -0.505 . . . . 0.0 109.822 -176.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 20.5 Cg_exo -65.0 -18.99 63.68 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.249 2.633 . . . . 0.0 114.704 -170.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 40.7 p -61.61 133.42 55.62 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.103 0.478 . . . . 0.0 111.769 -176.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.78 -29.17 70.51 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -177.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.563 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.97 -37.75 61.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.864 -176.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 69' ' ' SER . 5.3 mm-40 -55.04 -68.4 0.19 Allowed 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.821 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.5 t -64.4 -38.38 90.82 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.921 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.56 -61.66 2.34 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.765 0.317 . . . . 0.0 110.575 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.5 mt-10 -60.87 -50.01 75.15 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.247 -175.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.663 HD12 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -64.57 -43.7 96.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.088 -173.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.3 m -64.78 -34.27 77.95 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.635 0.255 . . . . 0.0 110.359 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -62.57 -40.2 96.11 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.663 HD12 HD12 ' A' ' 80' ' ' ILE . 82.3 mt -60.53 -45.75 92.67 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.132 0.491 . . . . 0.0 110.143 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.624 ' HZ3' ' HB3' ' A' ' 105' ' ' ALA . 44.3 m0 -60.79 -57.35 13.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.718 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.533 ' O ' ' HB2' ' A' ' 89' ' ' PHE . 26.0 tt0 -61.51 -23.6 66.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.075 0.464 . . . . 0.0 110.484 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.47 -31.89 58.38 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.026 175.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.2 m -94.23 -63.42 1.19 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.492 HD21 HG13 ' A' ' 118' ' ' ILE . 6.1 mp -62.23 -46.99 86.37 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -173.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.533 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 33.8 m-85 -71.36 -11.32 60.84 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.467 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -70.46 -46.3 64.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 173.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.79 -10.17 59.21 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.977 173.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.7 t30 72.59 48.42 0.22 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.14 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -74.36 100.83 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -73.39 84.38 1.46 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.43 0.633 . . . . 0.0 110.933 -175.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.79 HG12 HD21 ' A' ' 109' ' ' LEU . 4.5 m -111.29 162.01 9.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.115 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.468 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.1 tp60 -101.32 103.79 14.78 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 173.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.597 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -102.04 130.16 48.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.439 -175.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -119.63 136.44 54.39 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.6 tt -118.65 107.07 20.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.281 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.48 139.87 10.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.07 103.23 0.13 Allowed Glycine 0 C--O 1.224 -0.488 0 C-N-CA 120.342 -0.933 . . . . 0.0 111.584 -176.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 p -46.85 -35.27 6.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.549 ' HB2' HG21 ' A' ' 3' ' ' ILE . 12.7 t70 -53.23 -38.96 63.41 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.601 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 51.7 mtt180 -138.31 167.43 21.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 122.182 0.991 . . . . 0.0 112.821 -167.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.624 ' HB3' ' HZ3' ' A' ' 84' ' ' TRP . . . -143.88 153.84 42.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.543 162.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.437 HG12 ' SD ' ' A' ' 108' ' ' MET . 12.4 tt -127.0 145.56 34.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -170.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -122.34 120.11 33.06 Favored 'General case' 0 CA--C 1.523 -0.063 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.978 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.655 ' HG3' ' SD ' ' A' ' 63' ' ' MET . 4.3 mpp? -103.45 124.09 48.08 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 173.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.79 HD21 HG12 ' A' ' 95' ' ' VAL . 9.1 mt -128.46 141.21 51.47 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.406 0.622 . . . . 0.0 111.479 -177.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.1 mtp-105 -105.91 6.28 31.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.255 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -139.31 138.75 36.97 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -121.57 24.96 7.06 Favored Glycine 0 N--CA 1.453 -0.2 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.474 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.0 m -60.3 -37.75 81.51 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.243 0.544 . . . . 0.0 110.482 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -117.13 24.96 10.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.853 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.07 -47.51 82.63 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.201 0.524 . . . . 0.0 111.061 -178.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -76.72 -20.1 56.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.175 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.14 -48.88 31.76 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.245 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.492 HG13 HD21 ' A' ' 88' ' ' LEU . 8.4 tt -63.5 -41.19 91.81 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.07 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.461 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 63.9 tttm -58.83 -45.27 90.42 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.268 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.3 -40.73 87.11 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.29 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -65.11 -44.2 89.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.1 mt -60.74 -38.63 85.79 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.369 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 31.2 m -87.38 -12.0 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-O 120.853 0.358 . . . . 0.0 111.174 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 17.7 t -86.77 2.05 50.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.383 175.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.554 HE22 ' HZ2' ' A' ' 84' ' ' TRP . 58.5 mt-30 -60.75 164.31 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.149 -176.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -54.44 -61.64 2.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.32 178.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -80.95 -11.28 59.6 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.55 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 60.0 m 65.77 114.62 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.087 0.555 . . . . 0.0 110.979 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -102.61 144.9 30.42 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.914 -177.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -91.61 127.25 36.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.974 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 43.6 t -106.53 109.86 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.254 -174.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.503 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 31.4 p -92.7 127.12 38.09 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 83.0 mt -87.19 163.17 17.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.926 0.393 . . . . 0.0 111.593 -172.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 62.2 tt0 . . . . . 0 C--N 1.331 -0.197 0 CA-C-N 115.333 -0.848 . . . . 0.0 111.412 176.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 121.217 0.532 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -56.64 -38.78 72.6 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.841 -178.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.77 -49.27 77.15 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 177.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -55.72 -43.31 76.41 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.954 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.448 ' OD1' ' HD2' ' A' ' 104' ' ' ARG . 0.9 OUTLIER -58.46 -53.34 59.39 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.151 -177.254 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -52.68 -61.56 2.21 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.84 -61.45 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.509 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.78 -60.0 4.36 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.075 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.441 ' O ' HD23 ' A' ' 15' ' ' LEU . 26.2 mmt -59.4 -52.1 67.08 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.226 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.72 89.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.794 0.33 . . . . 0.0 111.084 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -72.15 -23.94 61.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.748 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.1 tp -80.71 -52.69 7.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.94 0.4 . . . . 0.0 110.625 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -68.08 -20.61 64.96 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.432 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -48.78 -38.28 21.48 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.504 0.668 . . . . 0.0 109.873 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -69.16 -43.68 73.78 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.002 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -59.04 -41.86 88.84 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 120.897 0.38 . . . . 0.0 110.715 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -61.71 -46.28 90.33 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.465 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.5 tmtt? -55.77 -40.88 73.24 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.439 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.438 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 7.4 m-20 -71.03 -44.67 65.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.33 -31.6 72.8 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 121.169 0.509 . . . . 0.0 109.808 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 6.2 m-20 -66.62 -44.98 80.6 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.766 174.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.3 mt -61.26 -34.18 59.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -69.09 -31.33 69.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.004 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.0 tp10 -64.99 -17.85 64.79 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.262 0.553 . . . . 0.0 110.071 170.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.68 29.42 13.6 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.239 -178.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -136.93 126.14 24.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 177.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.446 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.9 mm? . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.629 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.257 0 CA-C-O 121.161 0.505 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 13.5 ptm -145.21 116.06 7.77 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.551 175.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 67.0 mtt -120.23 144.77 47.57 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.55 -174.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' HB3' ' HD3' ' A' ' 104' ' ' ARG . 41.6 m-85 -123.75 100.31 6.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.954 177.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.584 HG21 HD13 ' A' ' 122' ' ' LEU . 16.3 t -91.96 109.73 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -171.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 57.9 m -79.91 104.69 10.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.07 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.429 HG11 HG12 ' A' ' 80' ' ' ILE . 25.5 t -101.86 -58.82 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.049 0.452 . . . . 0.0 111.193 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.721 ' HB2' ' HA ' ' A' ' 103' ' ' ASP . 5.1 m -65.44 -69.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.217 -170.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.21 3.66 89.72 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.45 -0.66 . . . . 0.0 111.45 -171.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 10.0 t30 -123.13 136.16 26.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 33.6 Cg_exo -60.35 -19.34 57.78 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.284 2.656 . . . . 0.0 114.301 -173.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.454 ' H ' ' ND2' ' A' ' 71' ' ' ASN . 6.4 m -81.63 140.96 34.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.24 -0.287 . . . . 0.0 110.446 -178.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -72.75 -19.67 61.33 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -171.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -32.16 -61.02 0.26 Allowed 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.616 0.722 . . . . 0.0 112.29 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.41 -51.98 63.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.617 -169.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.581 HG23 HD11 ' A' ' 99' ' ' ILE . 9.6 t -66.04 -33.97 77.01 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.83 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.21 -52.63 57.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.897 0.38 . . . . 0.0 110.126 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.1 -49.4 76.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.104 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.559 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.1 tp -67.52 -42.96 87.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -175.11 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.408 HG21 ' HB ' ' A' ' 99' ' ' ILE . 73.4 m -68.7 -25.13 64.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.685 0.279 . . . . 0.0 110.405 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.8 t -67.31 -48.52 67.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 173.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.486 HD12 HD12 ' A' ' 80' ' ' ILE . 86.1 mt -55.24 -43.7 74.81 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.335 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.633 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.8 m0 -67.01 -43.83 81.9 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.118 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -55.16 -28.83 55.71 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.365 0.602 . . . . 0.0 109.592 175.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -76.26 -68.2 1.57 Allowed Glycine 0 CA--C 1.518 0.233 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.225 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.7 m -57.54 -54.4 47.24 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.3 mp -64.1 -29.0 70.16 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 111.281 -172.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -101.29 6.24 42.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.475 0.655 . . . . 0.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -89.68 -32.33 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 167.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.56 -14.39 37.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.637 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.0 m120 66.51 80.33 0.22 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.269 176.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -111.58 120.71 43.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.793 171.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.42 83.03 1.95 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.239 0.542 . . . . 0.0 110.254 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.624 HG23 ' HD2' ' A' ' 97' ' ' ARG . 12.5 m -111.07 148.78 14.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.852 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.447 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.5 tp60 -100.79 100.56 11.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.785 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -125.67 141.23 52.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.204 -169.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.46 ' O ' HG22 ' A' ' 106' ' ' ILE . 81.5 m-85 -138.72 135.63 34.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.304 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.581 HD11 HG23 ' A' ' 77' ' ' THR . 5.0 tt -87.0 89.76 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.536 0.684 . . . . 0.0 109.445 173.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -135.28 130.71 51.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.307 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 93.83 103.43 1.7 Allowed Glycine 0 C--O 1.225 -0.465 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -171.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -40.9 -34.9 0.45 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.721 ' HA ' ' HB2' ' A' ' 69' ' ' SER . 7.8 p-10 -89.56 -48.4 7.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.521 0.2 . . . . 0.0 111.472 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.529 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 61.6 mtt180 -88.51 155.0 19.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -173.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -128.35 140.72 51.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.379 165.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 98' ' ' PHE . 8.0 tt -109.69 132.09 58.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 111.433 -172.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -123.22 107.69 11.98 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.261 176.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.419 ' SD ' HD11 ' A' ' 15' ' ' LEU . 66.5 mtm -102.1 118.81 37.68 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.52 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 28.6 mt -110.89 131.39 55.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.436 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 29.8 mmm-85 -88.99 4.26 48.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.347 0.594 . . . . 0.0 109.601 173.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -146.13 135.08 22.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.336 176.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -114.11 23.54 12.65 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.99 -176.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.2 t -64.67 -44.87 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -101.61 26.52 7.25 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.005 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -50.38 72.88 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.131 0.491 . . . . 0.0 111.753 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -28.54 62.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 -177.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -69.02 -48.41 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.42 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.587 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.2 tt -63.93 -41.41 92.41 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.497 ' HG2' HG11 ' A' ' 131' ' ' VAL . 14.1 tmtt? -57.56 -49.88 74.92 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 121.05 0.452 . . . . 0.0 110.229 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -56.65 -40.79 76.08 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.553 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -66.14 -47.71 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.918 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 88.8 mt -53.46 -44.77 69.18 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.403 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 28.7 m -81.77 -14.68 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.734 0.302 . . . . 0.0 111.481 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -74.26 1.55 11.17 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.769 0.427 . . . . 0.0 111.633 175.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.633 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.4 mp0 -76.85 164.53 25.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.401 0.619 . . . . 0.0 112.408 -174.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -79.76 -45.67 18.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.567 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -66.84 -3.17 6.22 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.726 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 43.6 t 62.51 91.32 0.07 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.222 0.534 . . . . 0.0 110.403 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.16 132.69 45.38 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.537 -177.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -108.27 124.53 50.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.841 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.508 ' HA ' ' HA ' ' A' ' 66' ' ' VAL . 6.5 p -102.84 127.97 56.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.103 0.478 . . . . 0.0 111.735 -173.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.6 m -87.06 121.33 29.37 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.2 tt -105.2 113.45 27.05 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -172.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 . . . . . 0 C--O 1.235 0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.068 -179.98 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mm . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 120.359 0.123 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -56.41 -50.54 71.33 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.588 0.233 . . . . 0.0 111.609 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.86 -48.97 74.59 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -47.84 73.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.176 176.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.575 ' O ' ' HB2' ' A' ' 11' ' ' MET . 93.4 m-20 -53.12 -76.41 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.947 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.64 -64.07 0.94 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.832 -176.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.548 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -65.59 -61.24 2.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.846 -171.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -74.95 -30.49 61.23 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -168.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.575 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 10.0 mmt -71.42 -37.43 71.48 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.222 175.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.92 -48.08 83.15 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.16 173.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 85.7 mtt180 -59.05 -45.31 91.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.188 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.509 HD21 ' HD2' ' A' ' 98' ' ' PHE . 61.3 tp -71.1 -53.2 15.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.853 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.465 HD23 ' O ' ' A' ' 11' ' ' MET . 4.1 mm? -69.12 -18.59 63.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.129 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -48.74 -49.95 35.91 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.021 0.439 . . . . 0.0 110.799 175.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.452 ' HG3' ' N ' ' A' ' 18' ' ' TRP . 7.1 pt20 -66.71 -35.22 79.61 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.548 -177.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.466 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 76.8 m95 -67.03 -42.24 85.2 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.088 0.471 . . . . 0.0 110.428 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.07 -48.89 79.94 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.581 ' O ' HG13 ' A' ' 24' ' ' ILE . 88.2 tttt -57.59 -45.75 84.9 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.668 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -58.13 -54.16 50.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.984 0.421 . . . . 0.0 110.846 -177.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.54 -39.36 79.98 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.669 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 4.0 m-20 -72.56 -30.73 64.68 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.514 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 20' ' ' LYS . 67.9 mt -65.11 -37.75 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.91 -26.7 60.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.547 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 4.9 mm-40 -62.14 -17.32 57.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.233 166.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.46 9.76 62.75 Favored Glycine 0 N--CA 1.453 -0.203 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.824 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.91 124.96 47.3 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 C--N 1.327 -0.379 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' HG ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.425 0 CA-C-O 121.901 0.858 . . . . 0.0 113.254 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.609 ' HE3' ' HG3' ' A' ' 134' ' ' GLU . 72.9 mtm -142.32 133.66 26.36 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.307 168.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.53 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 63.0 mtt -114.64 129.15 56.64 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -172.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.518 ' HE1' ' HA ' ' A' ' 134' ' ' GLU . 43.5 m-85 -91.1 116.46 28.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 168.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -112.96 108.2 24.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.665 0.269 . . . . 0.0 110.965 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 37.8 m -77.15 106.52 8.92 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.418 HG21 HG23 ' A' ' 77' ' ' THR . 97.9 t -85.24 -61.05 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.081 0.467 . . . . 0.0 111.682 -172.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.5 t -91.65 -41.61 10.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.931 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.56 -10.18 65.41 Favored Glycine 0 C--N 1.33 0.243 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -167.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.579 HD21 HG23 ' A' ' 73' ' ' THR . 8.2 t30 -126.23 130.82 23.85 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 123.865 0.866 . . . . 0.0 109.004 178.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 80.0 Cg_exo -46.3 -16.61 0.25 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.185 3.257 . . . . 0.0 116.263 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.579 HG23 HD21 ' A' ' 71' ' ' ASN . 19.9 p -60.18 97.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.682 0.674 . . . . 0.0 112.347 -172.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.413 ' CA ' ' HB3' ' A' ' 102' ' ' SER . 40.0 tt0 -43.34 -30.92 0.57 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.132 -0.94 . . . . 0.0 112.415 176.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -35.04 -66.9 0.16 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 123.998 0.811 . . . . 0.0 111.935 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -62.93 -43.75 97.94 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.975 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.418 HG23 HG21 ' A' ' 68' ' ' VAL . 38.6 m -63.93 -39.8 94.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.282 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.54 -50.01 60.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.384 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.84 -54.16 45.97 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 120.985 0.422 . . . . 0.0 110.929 177.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.635 HD12 HD12 ' A' ' 83' ' ' LEU . 10.2 tp -67.07 -40.0 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.324 -174.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.461 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 70.5 m -61.48 -37.34 83.26 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.673 0.273 . . . . 0.0 110.394 176.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.401 ' HA ' HE21 ' A' ' 85' ' ' GLN . 50.9 m -61.02 -44.84 96.82 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 80' ' ' ILE . 78.3 mt -58.53 -47.48 84.04 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 176.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.726 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 48.9 m0 -58.7 -45.87 88.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.093 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.6 mt-30 -58.51 -60.03 4.44 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.44 -40.06 10.73 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.342 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 m -73.17 -58.02 3.61 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 111.373 -178.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.3 mt -57.99 -54.14 50.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -174.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -65.94 -31.13 71.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.38 -174.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.66 -24.07 59.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.282 0.563 . . . . 0.0 109.723 176.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.13 14.4 12.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.43 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.5 t30 73.26 9.46 5.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.703 175.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -81.28 91.92 6.29 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.038 -0.413 . . . . 0.0 109.968 176.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.77 94.46 7.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.08 165.25 16.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.316 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.499 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.1 tp60 -104.53 152.97 21.74 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 177.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.538 ' HD3' ' N ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -155.65 126.82 7.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.78 0.324 . . . . 0.0 110.36 -177.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.509 ' HD2' HD21 ' A' ' 14' ' ' LEU . 15.8 m-30 -113.82 124.15 51.53 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 tt -102.32 88.77 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 122.136 0.97 . . . . 0.0 109.734 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.39 141.98 45.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.111 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 67.19 76.27 0.39 Allowed Glycine 0 C--O 1.224 -0.489 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -169.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.413 ' HB3' ' CA ' ' A' ' 74' ' ' GLU . 24.6 m -35.21 -34.6 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -165.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.76 -34.17 72.63 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.176 0.513 . . . . 0.0 111.849 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 88.3 mtt180 -128.09 134.69 49.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.162 0.506 . . . . 0.0 111.93 -171.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.64 128.56 54.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.539 -0.755 . . . . 0.0 108.975 173.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.6 tt -104.46 133.14 49.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 110.704 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -116.11 129.62 56.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.07 -177.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.573 ' HA ' ' HG2' ' A' ' 63' ' ' MET . 2.0 mpt? -108.87 122.71 47.77 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.679 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' A' ' 62' ' ' LEU . 0.8 OUTLIER -128.01 114.75 17.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 172.1 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -61.79 -34.32 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -170.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -118.38 111.49 18.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.101 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.54 48.46 3.9 Favored Glycine 0 C--N 1.332 0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.166 -174.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.4 t -68.39 -71.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.981 0.419 . . . . 0.0 110.003 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.1 p90 -80.54 30.17 0.3 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.631 177.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.82 -41.53 82.42 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.234 0.54 . . . . 0.0 111.445 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . 0.413 ' HA ' ' HE3' ' A' ' 119' ' ' LYS . 21.0 m95 -75.11 -32.89 61.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.009 -174.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.83 -53.57 44.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.153 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.592 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.2 tt -61.62 -38.36 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.079 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.53 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 24.5 ttpp -53.51 -55.55 24.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.144 0.497 . . . . 0.0 110.788 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.668 ' HA ' HG22 ' A' ' 123' ' ' VAL . 3.3 m-20 -64.22 -30.99 72.02 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.846 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -64.93 -36.51 84.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.959 0.409 . . . . 0.0 110.034 176.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 81.3 mt -67.43 -46.26 73.67 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.278 178.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.668 HG22 ' HA ' ' A' ' 120' ' ' ASP . 12.5 m -82.21 -4.51 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.582 -177.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.4 t -70.04 1.24 4.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.92 0.488 . . . . 0.0 111.765 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.726 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -83.19 143.11 30.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.007 0.432 . . . . 0.0 111.529 -174.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -43.89 -62.35 1.15 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.063 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 48.9 ttt180 -80.78 21.24 0.69 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 56.6 m 70.99 -166.94 0.15 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.701 0.4 . . . . 0.0 111.779 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 171.71 119.41 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.603 -176.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 34.8 mt-10 -87.17 144.14 26.98 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.2 p -138.72 139.72 40.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.926 0.393 . . . . 0.0 111.302 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 18.2 p -138.33 140.47 39.51 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 176.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 61.3 mt -88.4 154.31 20.48 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.639 0.257 . . . . 0.0 111.172 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.609 ' HG3' ' HE3' ' A' ' 63' ' ' MET . 1.7 tm-20 . . . . . 0 C--N 1.331 -0.218 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 176.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.778 HG12 ' HB3' ' A' ' 6' ' ' TYR . 15.0 tt . . . . . 0 CA--C 1.545 0.76 0 CA-C-O 122.316 1.055 . . . . 0.0 109.039 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -55.41 -43.41 75.25 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 114.495 -1.23 . . . . 0.0 112.274 -169.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.98 -46.13 71.59 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.082 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.778 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -58.57 -47.15 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.989 176.656 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.571 ' O ' ' HB2' ' A' ' 11' ' ' MET . 90.6 m-20 -55.15 -71.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.405 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -51.23 -69.47 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.093 -178.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.17 -58.75 7.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.746 -171.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.96 -45.97 55.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.915 -168.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.571 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 17.2 mmt -69.01 -43.27 75.14 Favored 'General case' 0 N--CA 1.461 0.125 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.707 -176.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.47 -49.94 67.19 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.835 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -67.95 -27.81 66.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.653 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -78.78 -52.09 8.86 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.891 0.377 . . . . 0.0 111.2 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -72.55 -25.13 61.25 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -173.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -59.75 -29.45 68.17 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -55.8 -58.11 9.21 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.854 174.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.1 m95 -58.94 -30.15 67.67 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.667 -178.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.82 -62.89 1.53 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.379 175.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.478 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.1 ttmt -57.37 -47.14 82.42 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.152 -178.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.42 -46.49 73.21 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 123.377 0.423 . . . . 0.0 110.632 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 28.6 t70 -61.64 -41.9 98.14 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.141 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -66.89 -24.87 66.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.08 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 20' ' ' LYS . 70.5 mt -71.28 -37.5 66.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 174.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -68.34 -31.55 71.02 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.571 173.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 22' ' ' ASP . 14.9 mm-40 -69.21 -35.38 76.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.349 0.595 . . . . 0.0 109.645 172.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.64 48.02 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.726 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -116.88 94.2 4.5 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.434 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.533 0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.027 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--O 1.235 0.296 0 CA-C-O 121.062 0.458 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.677 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 17.1 ptm -140.87 111.74 7.07 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.867 176.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.5 mtt -113.47 130.21 56.38 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.385 -174.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -100.05 118.86 37.31 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.442 HG22 HG13 ' A' ' 131' ' ' VAL . 35.4 t -113.94 101.7 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 -175.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.645 HG23 ' HB2' ' A' ' 130' ' ' GLU . 5.1 t -83.19 106.2 14.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 109.459 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.438 HG11 HG12 ' A' ' 80' ' ' ILE . 17.3 t -101.29 -60.78 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.831 -173.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.3 t -72.57 -59.7 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.685 -176.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.508 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 75.62 0.92 64.57 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.523 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.459 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 9.1 t30 -126.26 132.29 24.26 Favored Pre-proline 0 CA--C 1.535 0.367 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 32.6 Cg_exo -58.71 -17.91 38.2 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.628 2.886 . . . . 0.0 114.513 -171.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.441 HG23 HD21 ' A' ' 71' ' ' ASN . 36.1 p -57.9 107.16 0.43 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 111.912 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -47.61 -31.27 4.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.04 0.936 . . . . 0.0 112.641 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.618 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 11.9 mptt -49.29 -50.88 37.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.135 0.493 . . . . 0.0 111.081 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.3 -50.33 74.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.452 -174.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.456 HG23 HD11 ' A' ' 99' ' ' ILE . 14.6 t -67.83 -39.47 83.88 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.793 -175.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.06 -53.3 59.91 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -54.95 -63.13 1.25 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.135 179.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.438 HG12 HG11 ' A' ' 68' ' ' VAL . 11.4 tp -63.41 -46.35 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.599 -171.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.4 HG21 ' HB ' ' A' ' 99' ' ' ILE . 55.3 m -67.99 -31.72 71.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.488 -0.132 . . . . 0.0 111.159 -177.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.1 t -67.73 -44.45 77.57 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 177.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 99.3 mt -60.69 -40.94 94.05 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.508 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 40.1 m0 -62.98 -47.79 81.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.664 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -55.73 -57.84 10.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.027 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -43.93 -58.34 4.33 Favored Glycine 0 C--N 1.333 0.395 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.991 173.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -49.53 75.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.59 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 95.3 mt -60.71 -56.57 19.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.083 -177.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -68.34 -20.3 64.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.07 -177.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -68.73 -38.0 79.85 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.164 0.507 . . . . 0.0 110.197 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.8 5.72 50.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.224 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 64.64 65.12 0.64 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.596 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.59 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 17.4 m-85 -102.1 88.16 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 168.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -77.21 72.57 3.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 109.785 -177.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.856 HG12 HD21 ' A' ' 109' ' ' LEU . 4.5 m -104.62 161.02 4.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.015 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.467 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.4 tp60 -102.0 105.42 16.18 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.744 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -119.96 145.35 46.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.972 -174.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.474 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 81.8 m-85 -130.97 127.01 37.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.068 0.461 . . . . 0.0 109.951 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.456 HD11 HG23 ' A' ' 77' ' ' THR . 7.5 tt -99.26 90.51 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.935 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -136.86 128.71 43.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.584 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.26 97.99 0.15 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 -172.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.9 m -45.19 -32.58 1.93 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -172.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.508 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 2.5 m-20 -57.47 -51.92 67.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.471 177.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.438 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 69.9 mtt180 -120.92 134.37 55.3 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -171.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.91 127.96 55.06 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 168.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.474 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 6.1 tt -98.71 132.94 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.989 0.423 . . . . 0.0 111.257 -177.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -124.22 123.8 41.05 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.593 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 76.6 mtm -128.12 146.81 50.59 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.267 0.556 . . . . 0.0 111.41 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.856 HD21 HG12 ' A' ' 95' ' ' VAL . 22.4 mt -133.28 137.64 46.1 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.436 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.37 -55.42 4.17 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 172.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -128.3 111.51 13.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.466 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.91 95.91 0.12 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.308 -176.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.5 t -70.66 -23.39 62.5 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 109.872 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.29 14.36 1.23 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.914 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.74 75.38 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.051 0.453 . . . . 0.0 111.529 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 16.8 m95 -79.49 -23.86 42.7 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.185 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -72.67 -48.45 39.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.881 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.1 tt -64.17 -41.29 91.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.6 -41.45 81.26 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.8 -40.8 94.04 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.153 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -60.66 -40.44 92.04 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.435 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 47.7 mt -65.96 -40.55 91.39 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.256 -178.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 24.6 m -81.07 -22.91 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 120.809 0.338 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.5 m -87.17 2.7 49.11 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.127 0.489 . . . . 0.0 110.583 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.508 ' NE2' ' NE1' ' A' ' 84' ' ' TRP . 6.6 tp-100 -66.74 156.47 35.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.621 -174.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -45.16 -67.74 0.26 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.001 0.52 . . . . 0.0 111.879 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -69.77 -17.84 63.45 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.604 177.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 42.3 t 68.8 116.59 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.609 0.568 . . . . 0.0 109.919 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.59 143.28 32.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.934 -175.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.645 ' HB2' HG23 ' A' ' 67' ' ' THR . 38.9 mt-10 -91.66 113.39 25.64 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.01 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.442 HG13 HG22 ' A' ' 66' ' ' VAL . 37.5 t -104.25 138.73 27.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -178.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.5 p -125.54 136.34 53.22 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 62.4 mt -94.13 110.89 22.58 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.677 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 53.8 mm-40 . . . . . 0 C--N 1.325 -0.461 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 -177.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt . . . . . 0 CA--C 1.536 0.434 0 CA-C-O 121.969 0.89 . . . . 0.0 108.796 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.5 ttm105 -51.95 -31.79 30.41 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.524 -176.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -54.73 -45.6 74.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.627 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.0 -44.04 98.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 178.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.566 ' O ' ' HB2' ' A' ' 11' ' ' MET . 1.1 m-80 -53.77 -70.39 0.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.45 -62.68 1.5 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.935 -175.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.49 -64.27 1.0 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.758 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -68.0 -39.44 83.23 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.672 -169.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 24.2 mmt -70.52 -45.99 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.979 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -59.65 -43.64 93.81 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.052 0.454 . . . . 0.0 110.484 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -72.54 -31.68 65.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.469 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.9 tp -71.59 -52.77 16.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.962 0.411 . . . . 0.0 110.29 177.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.76 -17.02 61.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.174 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 16.5 tp10 -51.07 -49.75 60.04 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 121.268 0.556 . . . . 0.0 110.206 173.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 21' ' ' ASP . 18.2 tt0 -64.93 -43.01 94.14 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 m95 -55.09 -41.88 72.16 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.612 0.57 . . . . 0.0 110.833 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.28 -52.32 66.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.649 ' HE2' HD11 ' A' ' 24' ' ' ILE . 88.2 tttt -62.22 -27.68 69.15 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.946 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 17' ' ' GLN . 35.6 m-20 -67.83 -49.39 62.47 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -72.27 -25.84 61.76 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.052 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -61.97 -54.6 39.45 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.285 0.564 . . . . 0.0 110.391 171.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.649 HD11 ' HE2' ' A' ' 20' ' ' LYS . 77.8 mt -59.17 -35.87 59.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.995 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.97 -42.64 99.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.195 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -78.2 3.29 15.62 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.034 0.445 . . . . 0.0 110.93 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.22 53.12 3.21 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 116.236 -0.438 . . . . 0.0 113.95 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -158.64 136.2 10.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.034 0.417 . . . . 0.0 111.171 175.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.578 HD13 HG12 ' A' ' 24' ' ' ILE . 2.5 mm? . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.416 HD13 ' HB1' ' A' ' 115' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 121.719 0.771 . . . . 0.0 112.738 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.453 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 18.0 ptp -136.47 127.27 27.37 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.739 -1.118 . . . . 0.0 108.786 172.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.7 mtt -110.35 125.32 53.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 0.0 111.344 -173.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.504 ' HE2' ' SD ' ' A' ' 11' ' ' MET . 49.8 m-85 -102.91 105.01 15.29 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.644 HG21 HD13 ' A' ' 122' ' ' LEU . 21.7 t -98.11 105.41 17.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.245 -171.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.8 m -79.02 103.5 9.01 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.63 HG11 HG12 ' A' ' 80' ' ' ILE . 26.0 t -96.18 -62.71 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.811 0.338 . . . . 0.0 111.739 -171.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.6 t -92.56 -64.3 1.12 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.426 -173.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 89.78 -9.25 77.86 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 -172.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -92.72 125.49 55.33 Favored Pre-proline 0 CA--C 1.532 0.273 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.38 -19.8 68.38 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.172 2.581 . . . . 0.0 114.21 -170.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.448 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.5 m -66.04 113.93 4.83 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 52.3 mt-10 -60.45 -24.65 65.39 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -168.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.534 ' HD3' ' N ' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -49.96 -31.23 12.07 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.894 0.378 . . . . 0.0 111.593 -178.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.534 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 31.6 mm-40 -60.37 -60.09 4.37 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.083 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.647 ' HB ' ' HA ' ' A' ' 102' ' ' SER . 15.1 t -62.82 -33.43 75.21 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.511 -178.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -54.94 -59.29 4.94 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.08 176.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -57.47 -54.54 45.71 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.149 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.657 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.6 tp -63.91 -44.95 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.779 -171.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.436 HG21 ' HB ' ' A' ' 99' ' ' ILE . 39.5 m -67.03 -34.29 77.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.543 0.211 . . . . 0.0 110.61 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.2 t -63.62 -45.09 91.83 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.896 0.379 . . . . 0.0 110.201 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.6 mt -62.64 -44.73 95.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.553 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.402 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 20.8 m0 -65.37 -43.78 89.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.859 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -60.2 -29.71 68.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.313 0.578 . . . . 0.0 110.091 172.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -77.9 -26.12 61.02 Favored Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 112.307 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.0 m -96.11 -56.26 2.7 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.96 -49.26 76.25 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.702 0.287 . . . . 0.0 111.597 -175.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -71.05 -21.62 62.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.769 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.25 -35.09 66.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.232 0.539 . . . . 0.0 109.762 174.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.65 7.32 34.09 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.481 176.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 65.82 70.39 0.44 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.463 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -130.3 95.77 3.99 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.293 171.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -84.16 70.87 10.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.615 0.721 . . . . 0.0 109.669 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 31.8 m -95.77 169.48 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.07 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.42 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -101.48 104.7 15.64 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.877 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.59 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.4 OUTLIER -111.51 138.49 47.97 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.25 -178.376 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.451 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.4 m-85 -130.0 150.85 51.1 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 175.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.436 ' HB ' HG21 ' A' ' 81' ' ' THR . 6.9 tt -130.75 96.81 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.399 -171.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -149.01 133.38 9.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 80.59 102.72 0.3 Allowed Glycine 0 C--O 1.227 -0.314 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.083 -173.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.647 ' HA ' ' HB ' ' A' ' 77' ' ' THR . 18.9 t -53.85 -28.27 34.85 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.913 0.387 . . . . 0.0 111.924 -174.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.584 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 10.0 p-10 -61.42 -36.84 81.45 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -134.39 141.2 46.77 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.54 137.75 53.01 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 167.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.451 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 10.2 tt -111.81 128.24 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.15 0.5 . . . . 0.0 111.633 -172.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -121.18 117.96 28.45 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.615 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.2 mtm -115.76 133.47 56.0 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.716 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 109' ' ' LEU . 4.2 mp -132.51 155.44 48.59 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.751 -176.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 110' ' ' ARG . 44.7 mtm105 -105.86 6.01 31.19 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 167.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -100.59 149.54 23.63 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.883 -177.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -131.36 19.16 4.87 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 175.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.9 t -93.98 -60.37 1.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.725 0.298 . . . . 0.0 110.222 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -99.07 8.26 45.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.937 0.398 . . . . 0.0 110.568 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.416 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -54.79 -38.03 66.79 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.21 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -76.11 -35.42 59.31 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.217 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -58.94 -52.5 65.48 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.406 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.6 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 4.3 tt -60.08 -42.53 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.34 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.471 ' HB3' ' HZ2' ' A' ' 119' ' ' LYS . 4.2 ttpm? -52.51 -54.88 26.62 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.344 0.592 . . . . 0.0 110.912 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.61 ' HA ' HG22 ' A' ' 123' ' ' VAL . 2.6 m-20 -65.17 -31.02 72.0 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.875 -177.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -64.48 -45.1 88.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.644 HD13 HG21 ' A' ' 66' ' ' VAL . 74.5 mt -58.36 -45.19 88.67 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.852 177.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.61 HG22 ' HA ' ' A' ' 120' ' ' ASP . 14.3 m -77.5 -17.51 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.758 0.313 . . . . 0.0 111.539 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -81.1 2.38 27.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 178.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.657 ' HG2' HD11 ' A' ' 80' ' ' ILE . 6.3 tp-100 -68.01 163.32 22.53 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.092 -174.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -66.08 -46.21 78.52 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.208 0.527 . . . . 0.0 109.752 -176.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -70.29 -20.94 63.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.432 174.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.4 m 66.11 167.33 0.21 Allowed 'General case' 0 CA--C 1.534 0.332 0 O-C-N 123.716 0.635 . . . . 0.0 109.296 -167.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.48 146.56 6.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.844 0.354 . . . . 0.0 111.322 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -94.53 112.78 24.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.553 176.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -96.55 112.34 28.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.218 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 65.3 p -95.43 132.16 40.8 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 67.7 mt -99.26 117.51 33.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -175.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.453 ' HB3' ' HG3' ' A' ' 63' ' ' MET . 10.8 tp10 . . . . . 0 C--O 1.237 0.412 0 CA-C-O 120.855 0.359 . . . . 0.0 110.54 -177.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.654 HG21 ' HB2' ' A' ' 103' ' ' ASP . 16.0 tt . . . . . 0 CA--C 1.54 0.575 0 CA-C-O 121.866 0.841 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.484 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 59.4 ttt-85 -59.55 -29.38 67.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.514 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -57.53 -46.5 83.77 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.457 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.1 OUTLIER -56.15 -44.33 79.17 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.702 173.223 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -53.45 -76.38 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -179.059 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.5 -59.83 4.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.485 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.571 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.94 -57.16 10.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.905 -171.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -69.58 -45.06 69.54 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.771 -171.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.421 ' SD ' ' HD2' ' A' ' 65' ' ' PHE . 25.4 mmt -63.72 -37.59 87.91 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.1 -50.58 72.68 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.848 0.356 . . . . 0.0 110.394 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 66.8 mtm180 -57.63 -45.5 85.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.268 -176.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -75.48 -52.23 11.17 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.537 -176.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.408 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -75.53 -15.95 60.33 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -172.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.62 -35.15 65.57 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.14 -42.04 99.41 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.485 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -61.44 -41.82 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.743 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.98 -42.74 94.28 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.503 ' O ' HG13 ' A' ' 24' ' ' ILE . 3.1 tttm -52.99 -52.09 59.47 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.048 176.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.432 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 13.5 m-20 -69.45 -35.63 75.84 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.442 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -56.9 -48.93 77.05 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -62.39 -44.81 95.57 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.12 177.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 20' ' ' LYS . 64.5 mt -59.03 -42.21 85.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.723 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.88 -13.2 59.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.538 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.65 -11.75 61.09 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.48 0.657 . . . . 0.0 109.312 166.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.24 28.1 11.18 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 114.288 171.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -154.07 152.5 30.54 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 169.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.6 mm? . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.43 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 HD13 ' A' ' 109' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.164 0.506 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.408 ' SD ' HD12 ' A' ' 15' ' ' LEU . 45.7 mtm -134.13 136.96 44.2 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 170.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.648 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 61.2 mtt -120.26 118.22 29.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.45 . . . . 0.0 111.185 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 13.1 m-85 -92.41 102.9 15.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 172.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.517 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 18.6 t -94.22 105.03 16.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.156 -170.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 47.7 m -77.25 101.4 6.22 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.015 178.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.475 HG11 HG21 ' A' ' 80' ' ' ILE . 42.8 t -101.43 -60.67 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.755 -177.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 t -81.75 -68.07 0.73 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.845 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.661 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 81.88 -10.71 51.15 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -169.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.416 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 8.5 t30 -109.25 133.73 20.69 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -64.5 -17.37 59.39 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.98 2.453 . . . . 0.0 114.702 -169.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.416 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 41.0 p -60.36 112.0 1.78 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.338 0.517 . . . . 0.0 111.221 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.419 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 10.4 pt-20 -57.98 -15.59 9.49 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.872 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -47.16 -54.18 11.25 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.075 175.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -58.5 -55.73 31.22 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.276 -0.874 . . . . 0.0 110.884 -172.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.495 ' HA ' HG22 ' A' ' 80' ' ' ILE . 10.6 t -63.73 -31.87 73.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.592 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.49 -52.95 62.38 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.208 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -58.03 -54.78 43.08 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.046 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.609 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.8 tp -65.32 -42.83 94.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.318 -173.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 86.2 m -68.38 -28.07 66.78 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.675 0.274 . . . . 0.0 110.436 178.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 48.3 t -62.85 -48.76 77.64 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 73.9 mt -58.67 -52.36 66.03 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.098 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.652 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 51.8 m0 -63.13 -29.97 71.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.406 -177.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.26 -60.19 3.73 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.42 -33.11 16.13 Favored Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.25 -0.887 . . . . 0.0 113.671 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.0 m -84.05 -67.89 0.76 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.77 -56.55 13.19 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 112.112 -172.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -76.53 -15.16 59.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.641 -170.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -80.32 -23.87 40.33 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.65 10.6 22.56 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.719 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.0 m120 70.63 24.89 4.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.826 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -71.54 100.07 2.18 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 173.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -85.36 69.86 10.75 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.495 0.664 . . . . 0.0 110.366 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.4 HG12 ' HG ' ' A' ' 109' ' ' LEU . 24.4 m -107.47 159.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.024 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.406 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -100.53 136.93 39.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.587 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -140.58 135.55 31.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.088 -169.304 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.415 ' O ' HG22 ' A' ' 106' ' ' ILE . 28.4 m-85 -130.46 132.37 45.65 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.587 174.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.483 HD11 HG23 ' A' ' 77' ' ' THR . 6.9 tt -109.69 89.75 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 109.9 179.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -138.24 131.77 41.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.85 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.03 98.47 0.11 Allowed Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 -172.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.419 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 15.0 m -49.29 -27.76 4.14 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.984 0.514 . . . . 0.0 112.315 -174.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.661 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 35.7 t70 -47.33 -47.37 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.561 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.517 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 51.0 mtt180 -135.98 147.09 47.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.557 0.694 . . . . 0.0 112.616 -172.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -112.32 122.5 47.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 166.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.712 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.7 tt -98.49 133.63 40.14 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.74 -173.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -126.89 109.63 12.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.504 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.712 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.5 mpp? -96.8 124.57 40.82 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 178.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.422 HD13 HD12 ' A' ' 62' ' ' LEU . 6.0 mp -111.72 102.98 11.24 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.55 -32.88 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 176.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -141.63 126.89 18.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.173 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 167.11 118.4 0.44 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.521 -0.847 . . . . 0.0 113.161 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.5 m -81.25 -18.86 44.52 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -79.57 33.7 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.11 -175.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.421 ' O ' HG22 ' A' ' 118' ' ' ILE . . . -61.95 -59.5 5.02 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.135 0.493 . . . . 0.0 111.857 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -26.94 64.06 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.884 0.373 . . . . 0.0 110.241 -176.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.52 -52.5 52.17 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.368 177.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.584 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 tt -62.57 -39.58 85.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.5 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 84.3 tttt -58.16 -43.16 87.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.12 176.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.565 ' HA ' HG22 ' A' ' 123' ' ' VAL . 27.0 t70 -63.56 -37.48 87.47 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.233 0.539 . . . . 0.0 110.181 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -66.14 -33.06 74.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.829 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.0 mt -68.72 -47.73 65.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.355 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.565 HG22 ' HA ' ' A' ' 120' ' ' ASP . 18.9 m -73.58 -8.67 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.2 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -65.32 -0.12 1.68 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.954 171.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.652 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.7 mp0 -101.59 85.94 2.85 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -178.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -55.71 -28.96 58.49 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.492 -175.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.513 ' O ' ' SG ' ' A' ' 128' ' ' CYS . 71.3 mtt85 -61.7 -46.25 90.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.18 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 127' ' ' ARG . 97.7 m -168.2 123.47 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -177.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.499 ' HB1' ' HA ' ' A' ' 123' ' ' VAL . . . -164.22 93.64 0.7 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.053 0.454 . . . . 0.0 111.526 -177.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.476 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 40.5 mt-10 -127.04 150.01 49.65 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 172.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.2 p -155.43 142.24 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.855 0.36 . . . . 0.0 111.348 -176.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 41.5 p -126.71 138.19 53.36 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.648 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 6.0 mp -97.68 172.24 7.83 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.569 -0.16 . . . . 0.0 110.569 -175.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -177.986 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.444 ' O ' HG12 ' A' ' 3' ' ' ILE . 13.6 tt . . . . . 0 CA--C 1.537 0.456 0 CA-C-O 121.547 0.689 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.516 ' HA ' HD22 ' A' ' 7' ' ' ASN . 49.6 ttt180 -56.02 -35.22 66.61 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.418 -177.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.23 -43.88 61.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.299 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.452 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -62.36 -42.21 99.22 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.883 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.531 ' O ' ' HB2' ' A' ' 11' ' ' MET . 49.0 m-80 -58.87 -66.4 0.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.865 -177.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -51.79 -60.82 2.73 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.454 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.571 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . . . -56.08 -70.95 0.1 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.58 -176.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 2.7 m-20 -60.9 -56.83 16.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.452 -174.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.531 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 10.8 mmt -60.84 -49.63 76.72 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.18 -172.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.483 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -64.14 -44.78 91.14 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.582 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.571 ' NH1' ' HA ' ' A' ' 9' ' ' ALA . 54.5 mtt85 -85.78 -1.95 57.74 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 17' ' ' GLN . 55.9 tp -95.56 -46.68 6.55 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 171.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.643 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -76.0 -20.96 57.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.373 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 31.3 tp10 -48.61 -40.54 27.88 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.776 0.798 . . . . 0.0 109.019 170.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.47 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 7.9 tt0 -60.26 -58.85 6.74 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 114.304 -1.317 . . . . 0.0 110.336 175.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 47.9 m95 -53.06 -38.45 62.48 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.682 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 43.3 mt-10 -67.52 -44.31 78.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.148 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.471 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -60.16 -50.0 75.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.158 177.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -58.03 -36.87 73.34 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 178.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.63 -50.48 72.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.411 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.73 -38.31 89.99 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.052 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.2 mt -63.02 -41.12 91.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.833 0.349 . . . . 0.0 110.546 178.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.44 -23.03 58.86 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.18 0.514 . . . . 0.0 109.883 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -72.19 -17.09 61.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.556 0.693 . . . . 0.0 109.368 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.48 21.29 35.05 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.898 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -132.43 115.83 16.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--N 1.33 -0.274 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.425 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.637 HD11 ' HE3' ' A' ' 64' ' ' MET . 3.3 tm? . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.643 ' SD ' HD12 ' A' ' 15' ' ' LEU . 21.6 ptt? -147.28 131.55 17.47 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.107 167.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.637 ' HE3' HD11 ' A' ' 62' ' ' LEU . 58.9 mtt -118.42 138.43 52.46 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.7 -170.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -103.83 114.31 28.47 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 168.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.563 HG21 HD13 ' A' ' 122' ' ' LEU . 21.6 t -114.39 112.03 38.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 118.007 0.367 . . . . 0.0 110.959 -172.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.659 HG23 ' HB2' ' A' ' 130' ' ' GLU . 7.9 t -98.16 123.81 42.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.06 -60.59 2.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.21 -174.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.7 t -92.8 -57.46 2.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.339 -172.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.72 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 91.25 29.64 12.16 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -168.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.673 ' HB3' ' HG3' ' A' ' 76' ' ' GLU . 10.3 t30 -125.19 132.77 24.39 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 122.858 0.463 . . . . 0.0 110.325 -178.364 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.4 -17.11 34.9 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.381 2.721 . . . . 0.0 114.406 -173.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.45 ' H ' ' ND2' ' A' ' 71' ' ' ASN . 4.7 m -81.47 139.37 35.23 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 112.069 -175.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -41.44 -49.24 3.9 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.631 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -39.1 -41.8 0.85 Allowed 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.773 0.671 . . . . 0.0 112.495 -167.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.673 ' HG3' ' HB3' ' A' ' 71' ' ' ASN . 9.8 mm-40 -59.74 -70.47 0.16 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.273 -174.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.455 HG21 ' HA ' ' A' ' 102' ' ' SER . 15.2 t -61.73 -38.64 88.67 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.859 0.361 . . . . 0.0 110.648 -178.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -53.67 -62.65 1.52 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.612 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.443 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 51.9 mt-10 -71.41 -38.69 71.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.816 -173.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.48 HD12 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -66.48 -39.94 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.395 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 90.2 m -69.02 -34.54 75.42 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.5 m -57.44 -45.21 84.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.109 174.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.48 HD12 HD12 ' A' ' 80' ' ' ILE . 83.6 mt -61.13 -51.86 67.29 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.225 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.4 m0 -62.25 -27.62 69.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.525 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.524 HE21 ' HB2' ' A' ' 89' ' ' PHE . 1.0 OUTLIER -72.19 -57.74 3.99 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 174.099 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.01 -12.72 7.53 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 115.693 -0.685 . . . . 0.0 113.672 176.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.4 m -95.92 -67.98 0.82 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 117.084 0.442 . . . . 0.0 110.862 174.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.5 mp -66.34 -56.45 11.05 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.713 -172.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.524 ' HB2' HE21 ' A' ' 85' ' ' GLN . 65.0 m-85 -66.13 -26.45 67.45 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.176 -176.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -72.16 -30.29 64.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 0.0 109.657 175.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.0 5.9 24.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.542 175.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 76.32 17.8 1.95 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.333 176.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -78.79 91.87 4.77 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -82.79 71.96 9.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.55 0.69 . . . . 0.0 109.967 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.412 HG12 HD21 ' A' ' 109' ' ' LEU . 5.6 m -88.14 178.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.421 178.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.583 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 4.9 tp60 -109.95 142.1 41.8 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 119.731 -0.787 . . . . 0.0 109.759 171.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.414 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.06 134.94 17.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.083 -178.01 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.438 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 29.5 m-85 -116.87 134.57 54.61 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 175.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -100.02 90.56 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.827 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.39 137.02 46.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.97 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.452 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 75.26 101.97 0.11 Allowed Glycine 0 C--O 1.225 -0.433 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 -169.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.455 ' HA ' HG21 ' A' ' 77' ' ' THR . 15.2 m -60.31 -10.08 4.27 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.72 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 4.1 p-10 -100.46 -4.85 28.03 Favored 'General case' 0 C--O 1.239 0.517 0 O-C-N 121.974 -0.454 . . . . 0.0 111.179 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 75.4 mtt180 -131.89 151.94 51.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.524 0.678 . . . . 0.0 111.831 -173.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.57 136.17 51.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.209 166.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.502 ' CD1' HD21 ' A' ' 15' ' ' LEU . 4.7 tt -112.46 128.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.429 . . . . 0.0 110.809 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -118.02 145.94 44.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.967 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.583 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -141.61 147.62 37.92 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-O 121.472 0.654 . . . . 0.0 110.837 175.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.412 HD21 HG12 ' A' ' 95' ' ' VAL . 89.6 mt -131.93 136.02 47.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.893 -177.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -92.47 -31.2 15.35 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 164.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.14 110.22 22.21 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.942 -1.026 . . . . 0.0 108.361 170.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -113.45 13.42 23.17 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.303 -173.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.4 t -61.55 -20.17 62.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.757 0.313 . . . . 0.0 111.366 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -118.68 19.02 13.32 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.862 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.492 ' HB1' ' HG ' ' A' ' 62' ' ' LEU . . . -62.03 -44.93 95.65 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.01 -176.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -33.88 77.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -174.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -61.16 -46.69 89.49 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.191 0.52 . . . . 0.0 109.745 177.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -62.04 -42.28 94.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.828 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -52.99 -53.56 48.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.114 0.483 . . . . 0.0 110.181 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.442 ' HA ' HG22 ' A' ' 123' ' ' VAL . 0.8 OUTLIER -60.35 -36.44 77.99 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.035 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -65.19 -48.55 73.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 0.0 110.046 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.563 HD13 HG21 ' A' ' 66' ' ' VAL . 88.3 mt -53.6 -47.07 70.53 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.459 177.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 120' ' ' ASP . 21.3 m -79.5 -13.74 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.363 -178.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.9 t -74.56 2.28 10.08 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.857 0.361 . . . . 0.0 111.457 175.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -78.26 164.81 24.57 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.019 0.438 . . . . 0.0 111.586 -176.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.9 -63.66 1.07 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.04 -172.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -75.16 -5.28 43.52 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.216 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 45.7 t 61.42 104.41 0.02 OUTLIER 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.318 0.58 . . . . 0.0 109.79 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.62 133.14 45.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.845 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.659 ' HB2' HG23 ' A' ' 67' ' ' THR . 50.3 mm-40 -83.35 113.25 20.6 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.481 HG23 HG22 ' A' ' 66' ' ' VAL . 7.5 p -109.7 134.22 52.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.851 -175.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 22.9 p -122.37 143.24 49.78 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 31.6 mt -107.67 135.23 49.45 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -175.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.614 HG12 ' HD2' ' A' ' 6' ' ' TYR . 12.8 tt . . . . . 0 CA--C 1.542 0.643 0 CA-C-O 121.036 0.446 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.567 ' HA ' ' OD1' ' A' ' 7' ' ' ASN . 99.2 mtt180 -58.72 -13.52 6.21 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -177.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.47 -49.84 71.44 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.519 177.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.614 ' HD2' HG12 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -69.68 -37.61 76.71 Favored 'General case' 0 C--N 1.338 0.065 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.626 -178.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 4' ' ' ARG . 14.7 m120 -48.9 -69.24 0.12 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 176.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.24 -68.12 0.22 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.047 -177.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.34 -59.97 4.45 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.665 -171.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.452 ' HB3' ' O ' ' A' ' 6' ' ' TYR . 23.5 t70 -66.91 -48.17 69.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.741 -170.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.55 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 6.0 mmt -69.98 -47.07 63.74 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.974 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.42 81.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.97 0.414 . . . . 0.0 110.764 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -68.87 -19.51 64.24 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.167 -178.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.18 -52.52 16.17 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 169.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.44 HD23 ' O ' ' A' ' 11' ' ' MET . 4.4 mm? -69.91 -15.08 63.01 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.808 -176.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -48.41 -55.49 10.7 Favored 'General case' 0 C--O 1.247 0.95 0 CA-C-O 121.533 0.682 . . . . 0.0 111.055 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -66.09 -29.59 69.95 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.53 -178.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.465 ' CH2' ' SD ' ' A' ' 108' ' ' MET . 45.2 m95 -64.05 -41.66 97.31 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -57.91 -47.91 81.45 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.51 ' O ' HG13 ' A' ' 24' ' ' ILE . 83.7 tttt -57.23 -40.71 78.11 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.04 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -62.17 -51.64 67.03 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.727 0.299 . . . . 0.0 110.948 -175.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.67 -25.48 60.28 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.745 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -39.67 85.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.767 0.318 . . . . 0.0 110.16 171.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.2 mt -62.5 -37.82 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -65.58 -34.95 79.44 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.922 175.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -71.37 -20.28 62.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.362 0.601 . . . . 0.0 109.68 174.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.05 35.05 7.28 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.796 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -143.82 132.13 22.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 176.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.4 mm? . . . . . 0 C--O 1.238 0.459 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.415 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.453 HD13 ' HA3' ' A' ' 112' ' ' GLY . 3.0 tt . . . . . 0 C--O 1.235 0.312 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.522 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 22.7 ptp -126.41 124.54 40.41 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.155 -179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.458 ' HG2' ' CD2' ' A' ' 133' ' ' LEU . 55.6 mtt -107.68 118.03 35.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.466 -176.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.453 ' CZ ' HD12 ' A' ' 106' ' ' ILE . 9.5 m-85 -100.49 126.55 46.92 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.413 HG11 ' CH2' ' A' ' 84' ' ' TRP . 25.8 t -113.01 100.72 11.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.856 0.36 . . . . 0.0 110.303 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.649 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 34.5 m -74.31 99.01 3.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.719 175.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.597 HG11 HG21 ' A' ' 80' ' ' ILE . 58.5 t -96.4 -55.94 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.195 0.521 . . . . 0.0 110.634 -175.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.419 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 9.7 m -87.36 -63.3 1.33 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.483 -172.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 82.1 -10.62 52.68 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 -169.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.608 HD21 HG23 ' A' ' 73' ' ' THR . 10.1 t30 -126.52 137.53 30.57 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -55.6 -17.21 16.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.876 3.051 . . . . 0.0 115.261 -171.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.608 HG23 HD21 ' A' ' 71' ' ' ASN . 9.8 p -49.78 100.02 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.46 ' HG3' ' H ' ' A' ' 74' ' ' GLU . 11.9 mt-10 -31.95 -44.94 0.09 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.928 1.291 . . . . 0.0 113.247 175.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.883 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 3.1 mptp? -51.58 -48.47 63.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.342 -166.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.419 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 14.7 mm-40 -58.66 -56.71 18.68 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.204 -174.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.481 HG21 ' HA ' ' A' ' 102' ' ' SER . 14.6 t -64.59 -37.13 86.5 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.559 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.91 -55.25 37.3 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 54.0 mt-10 -58.77 -55.44 35.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.769 -178.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.597 HG21 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -63.26 -47.4 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.499 -172.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.481 HG21 ' HB ' ' A' ' 99' ' ' ILE . 45.0 m -68.88 -31.67 70.77 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.206 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 18.9 t -68.82 -41.23 78.9 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 98.6 mt -61.21 -46.47 90.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.765 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 40.8 m0 -61.65 -36.58 81.19 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.841 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -59.52 -65.95 0.59 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -51.39 -28.73 21.28 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.325 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.8 m -87.82 -61.76 1.65 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.641 0.721 . . . . 0.0 111.923 -178.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.1 -53.68 46.72 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.261 0.553 . . . . 0.0 111.248 -176.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -76.76 -10.81 59.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.533 -171.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -84.92 -33.19 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 172.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.21 2.21 28.78 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.187 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 74.12 20.15 2.8 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.707 175.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -82.86 71.19 9.96 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 171.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.26 82.27 3.74 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.466 0.651 . . . . 0.0 110.665 -176.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.4 m -87.76 175.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.023 174.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.504 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 5.6 tp60 -99.77 120.68 40.12 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.696 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -119.72 125.89 49.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.719 -164.526 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -128.38 113.15 15.21 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.481 ' HB ' HG21 ' A' ' 81' ' ' THR . 6.0 tt -100.27 90.19 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.635 0.731 . . . . 0.0 109.505 175.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.76 125.01 51.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.498 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.01 102.01 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.147 -0.781 . . . . 0.0 111.147 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.481 ' HA ' HG21 ' A' ' 77' ' ' THR . 21.9 m -47.47 -22.14 0.42 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.453 ' HB2' HG21 ' A' ' 3' ' ' ILE . 17.4 t70 -54.34 -60.49 3.28 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.311 177.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -130.02 136.64 49.62 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.074 0.464 . . . . 0.0 111.688 -174.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -107.69 130.61 54.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 172.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.453 HD12 ' CZ ' ' A' ' 65' ' ' PHE . 7.8 tt -109.27 129.46 63.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-O 121.255 0.55 . . . . 0.0 112.267 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -112.7 122.21 47.01 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.188 172.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.465 ' SD ' ' CH2' ' A' ' 18' ' ' TRP . 61.1 mtt -101.16 133.09 46.23 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -110.62 131.65 54.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.653 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -77.5 -46.68 21.7 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 169.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -134.49 131.24 37.8 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.167 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . 0.453 ' HA3' HD13 ' A' ' 62' ' ' LEU . . . -120.26 56.95 0.59 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.99 -173.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.5 m -63.93 -51.17 65.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.284 0.564 . . . . 0.0 109.571 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -83.44 29.69 0.5 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.451 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.64 -49.14 77.44 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.943 0.402 . . . . 0.0 111.706 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -74.7 -23.7 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.951 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -68.43 -52.66 30.22 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.987 0.422 . . . . 0.0 109.895 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.609 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.0 tt -64.85 -40.92 90.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.279 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -58.61 -44.5 89.94 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.92 0.391 . . . . 0.0 110.119 177.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.35 -43.79 83.75 Favored 'General case' 0 C--O 1.239 0.553 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.92 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -63.54 -36.58 84.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.105 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.6 mt -66.31 -45.37 80.56 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.906 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.9 m -78.52 -12.1 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.367 -178.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.3 t -62.6 2.13 0.31 Allowed 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.765 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -106.85 131.72 53.63 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 122.08 -0.387 . . . . 0.0 111.568 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -66.22 -18.07 65.12 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.909 170.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 24.2 mmm180 -58.5 -13.61 5.98 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.565 174.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 127' ' ' ARG . 49.5 t 78.25 143.7 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.891 0.744 . . . . 0.0 110.824 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.19 99.02 0.62 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.79 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.649 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 5.9 mm-40 -83.34 111.83 19.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 174.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 50.1 t -98.2 121.92 49.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.262 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 p -132.02 122.08 24.93 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.738 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.458 ' CD2' ' HG2' ' A' ' 64' ' ' MET . 21.8 mt -87.56 127.67 35.26 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.522 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 39.9 mm-40 . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 121.265 0.555 . . . . 0.0 110.096 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 CA--C 1.538 0.495 0 CA-C-O 120.919 0.39 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -58.51 -34.04 70.51 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -51.33 -50.87 58.61 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.276 0.56 . . . . 0.0 110.092 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -48.28 82.39 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.16 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 11' ' ' MET . 30.1 m-80 -51.73 -66.77 0.33 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.397 -176.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.59 -59.8 4.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.01 -64.76 0.84 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.945 0.403 . . . . 0.0 111.703 -173.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -64.95 -48.88 72.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.315 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' ' HE1' ' A' ' 65' ' ' PHE . 4.3 mmt -65.19 -44.72 87.49 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.897 -175.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.65 -51.07 66.78 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.802 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -62.59 -31.86 72.76 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.63 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.0 tp -76.41 -53.26 8.39 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.844 0.354 . . . . 0.0 111.181 177.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.652 HD12 ' SD ' ' A' ' 63' ' ' MET . 4.3 mm? -68.79 -17.41 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.046 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -60.11 -35.19 74.7 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.013 0.435 . . . . 0.0 109.873 174.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -62.42 -50.04 73.09 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.59 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 33.3 m95 -54.38 -42.71 70.68 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.797 -178.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -56.57 -54.44 45.86 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 173.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.616 ' O ' HG13 ' A' ' 24' ' ' ILE . 77.5 tttt -56.73 -35.65 68.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.358 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -64.01 -55.66 20.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.81 0.338 . . . . 0.0 111.136 -178.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -74.28 -22.52 59.26 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.572 -175.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.517 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 27.6 m-20 -75.59 -28.45 58.93 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 172.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.616 HG13 ' O ' ' A' ' 20' ' ' LYS . 63.6 mt -68.2 -32.62 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -65.58 -35.85 82.03 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.718 172.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.517 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 31.5 mm-40 -55.83 -16.83 5.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.006 0.431 . . . . 0.0 110.683 169.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.05 14.15 55.14 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.001 171.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -138.55 146.54 42.01 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.43 HD13 HG12 ' A' ' 24' ' ' ILE . 3.3 mm? . . . . . 0 C--O 1.236 0.375 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.819 -176.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.1 mt . . . . . 0 C--O 1.237 0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.652 ' SD ' HD12 ' A' ' 15' ' ' LEU . 44.9 mtm -140.09 110.23 6.54 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 174.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.656 ' HG2' HD23 ' A' ' 133' ' ' LEU . 63.0 mtt -110.3 133.04 53.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.401 -171.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.595 ' HE1' ' SD ' ' A' ' 11' ' ' MET . 68.0 m-85 -95.28 134.36 38.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 168.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 20.7 t -126.62 106.95 16.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.486 HG23 ' HB2' ' A' ' 130' ' ' GLU . 3.0 t -91.44 110.69 22.0 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.15 -60.86 2.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.068 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 10.8 m -71.76 -44.6 63.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.705 -173.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.678 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 69.08 2.96 34.38 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.238 -0.506 . . . . 0.0 111.852 -172.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . 0.515 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 53.3 t30 -126.25 132.26 24.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.516 ' O ' ' HB3' ' A' ' 102' ' ' SER . 10.4 Cg_endo -50.79 -16.52 2.45 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 123.556 2.837 . . . . 0.0 113.941 -179.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.8 p -64.74 90.96 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.988 0.423 . . . . 0.0 110.615 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -53.76 -30.57 45.03 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.015 -177.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -40.4 -46.35 2.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.469 0.708 . . . . 0.0 112.515 -178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.437 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 60.8 mm-40 -63.28 -49.95 72.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.455 -177.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.478 ' HA ' HG22 ' A' ' 80' ' ' ILE . 91.8 m -62.82 -34.78 78.03 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.763 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.96 -51.87 67.43 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.501 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.39 -47.21 80.06 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.293 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.542 HD12 HD12 ' A' ' 83' ' ' LEU . 10.9 tp -65.28 -41.78 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.029 -0.269 . . . . 0.0 110.927 -177.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.0 m -64.73 -34.05 77.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.935 0.398 . . . . 0.0 110.409 177.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 t -60.39 -44.48 95.63 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.542 HD12 HD12 ' A' ' 80' ' ' ILE . 84.2 mt -59.01 -44.42 91.69 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.018 175.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.611 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 52.5 m0 -56.64 -38.88 72.75 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.752 179.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -63.96 -56.34 15.87 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.72 -15.65 13.51 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.624 -0.717 . . . . 0.0 114.02 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.3 m -96.37 -65.24 0.98 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.574 0.687 . . . . 0.0 111.337 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.38 -51.57 68.94 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.353 -175.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -72.77 -20.16 61.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -67.54 -36.2 80.53 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 172.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.8 1.72 48.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.408 175.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 67.7 31.53 5.93 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.408 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -77.76 100.74 6.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.159 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -77.38 89.66 3.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.404 0.621 . . . . 0.0 110.617 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.1 m -119.52 157.32 21.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.241 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.59 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.8 tp60 -101.92 103.92 14.6 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.561 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -107.94 135.79 48.73 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.919 -177.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.404 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 17.4 m-85 -120.71 121.28 37.92 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.0 tt -92.18 88.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 122.139 0.971 . . . . 0.0 109.268 174.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.28 134.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 177.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 99.9 103.06 2.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -166.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.516 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 16.4 m -37.3 -51.32 1.06 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -171.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.678 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.2 p-10 -101.05 -4.78 26.76 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.795 0.331 . . . . 0.0 111.441 -177.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -113.44 126.18 55.05 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.33 -168.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -115.24 130.77 57.0 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 170.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.46 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.9 tt -108.74 146.43 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.832 0.349 . . . . 0.0 111.445 -178.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -132.65 126.96 33.84 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.908 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.481 ' HG3' ' HG2' ' A' ' 63' ' ' MET . 3.6 mpp? -115.35 122.58 46.31 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 174.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.432 ' N ' HD12 ' A' ' 109' ' ' LEU . 5.7 mp -109.14 139.63 43.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.566 -178.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -104.2 5.93 35.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.27 0.557 . . . . 0.0 109.782 174.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -137.45 146.73 44.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.388 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -125.01 20.66 6.68 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.36 -174.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.6 m -76.74 -46.38 25.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.411 0.624 . . . . 0.0 110.127 179.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -105.48 22.44 15.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.076 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.29 -49.15 78.75 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.163 0.506 . . . . 0.0 111.611 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -23.83 56.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.115 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.33 -45.21 60.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.643 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.4 tt -66.26 -39.89 85.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -57.6 -41.01 80.36 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.122 0.487 . . . . 0.0 109.981 173.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.471 ' HA ' HG22 ' A' ' 123' ' ' VAL . 31.2 t70 -63.54 -41.15 98.47 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.587 178.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -62.51 -36.4 82.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.064 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 92.7 mt -66.43 -49.73 65.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.863 178.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.471 HG22 ' HA ' ' A' ' 120' ' ' ASP . 19.3 m -72.05 -13.44 16.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.932 0.396 . . . . 0.0 110.905 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 25.2 t -69.85 2.2 3.64 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.708 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.611 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 73.6 mt-30 -88.23 92.31 9.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.394 0.616 . . . . 0.0 110.192 -178.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -49.28 -40.96 36.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.72 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.45 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 98.1 mtt180 -56.6 -48.23 77.88 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 127' ' ' ARG . 51.3 t 165.8 138.12 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.461 0.475 . . . . 0.0 110.191 -174.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 179.54 110.69 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.495 0.497 . . . . 0.0 110.935 175.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . 0.486 ' HB2' HG23 ' A' ' 67' ' ' THR . 35.9 mt-10 -108.02 116.76 32.55 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 172.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.54 138.25 39.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.871 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.5 m -149.31 153.54 37.64 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.656 HD23 ' HG2' ' A' ' 64' ' ' MET . 70.7 mt -85.92 156.02 20.68 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.647 0.26 . . . . 0.0 110.465 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.586 ' HG2' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.384 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 175.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.611 HG12 ' HB3' ' A' ' 6' ' ' TYR . 14.0 tt . . . . . 0 CA--C 1.537 0.448 0 CA-C-O 121.95 0.881 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -65.97 -16.89 64.29 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.426 -174.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -57.39 -46.34 83.54 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.611 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.7 OUTLIER -62.6 -47.13 85.15 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.025 174.75 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.433 HD22 ' N ' ' A' ' 7' ' ' ASN . 0.9 OUTLIER -54.0 -68.05 0.21 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -178.4 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -50.02 -64.59 0.76 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.255 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 13' ' ' ARG . . . -57.56 -62.53 1.72 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.277 -172.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 16.6 t70 -64.09 -63.39 1.17 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.56 -174.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 14.0 mmt -54.75 -55.75 26.57 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.815 0.34 . . . . 0.0 110.846 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.09 -53.78 10.2 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.3 -173.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 9' ' ' ALA . 35.5 mtt180 -80.13 -8.2 59.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.746 -167.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.534 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 52.5 tp -98.96 -52.98 3.4 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 171.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.26 -11.4 60.9 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.584 0.23 . . . . 0.0 111.358 -175.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -48.47 -48.94 37.42 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.18 171.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 11.3 pt20 -57.43 -38.16 73.95 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.382 -175.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -64.63 -39.22 93.32 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.948 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.77 -47.38 85.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.3 ttpm? -63.32 -33.28 75.17 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.214 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -63.67 -48.37 77.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 109.946 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.77 -37.82 71.62 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.672 175.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 72.7 m-20 -68.43 -40.33 81.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.407 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.8 mt -62.51 -38.37 81.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 CA-C-O 121.363 0.601 . . . . 0.0 109.662 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -70.91 -28.69 64.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.237 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 10.0 tp10 -64.29 -12.07 38.05 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.127 172.047 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.13 21.87 34.27 Favored Glycine 0 C--N 1.333 0.381 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.687 173.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -152.03 153.06 33.24 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.184 0.516 . . . . 0.0 111.469 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.168 175.213 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 133' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 121.416 0.627 . . . . 0.0 112.468 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.589 ' HB2' ' HB3' ' A' ' 134' ' ' GLU . 35.3 mtp -126.74 148.67 49.87 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.54 ' HE1' ' O ' ' A' ' 115' ' ' ALA . 62.4 mtt -130.79 118.79 21.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -175.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.469 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 25.1 m-85 -98.95 97.41 8.58 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 171.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.538 HG21 HD13 ' A' ' 122' ' ' LEU . 22.0 t -88.76 110.42 21.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.876 0.369 . . . . 0.0 111.466 -172.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.0 m -74.24 96.04 2.73 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.72 HG11 HG21 ' A' ' 80' ' ' ILE . 46.3 t -90.42 -48.46 14.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.314 0.578 . . . . 0.0 110.775 -174.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.836 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 43.7 t -90.97 -61.04 1.75 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.22 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 75.91 -3.2 52.09 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -168.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -119.78 134.38 23.91 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 109.695 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.16 -17.74 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.66 2.906 . . . . 0.0 114.832 -173.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.517 HG22 ' HD3' ' A' ' 75' ' ' LYS . 1.1 m -78.21 145.39 35.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.311 0.505 . . . . 0.0 110.343 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -85.27 -22.68 28.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -163.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.521 ' HD3' ' H ' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.06 -42.04 17.98 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.503 0.668 . . . . 0.0 110.706 -173.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -65.62 0.57 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.419 -175.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.417 HG21 ' HA ' ' A' ' 102' ' ' SER . 15.3 t -63.73 -37.13 86.19 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.784 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.24 -58.31 9.08 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.136 0.493 . . . . 0.0 110.524 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -60.69 -46.82 88.91 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.433 -177.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.72 HG21 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -68.16 -40.18 82.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.406 -175.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 97.4 m -64.96 -35.96 82.87 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.1 t -62.22 -42.61 99.46 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.983 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.99 -49.02 79.14 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.194 0.521 . . . . 0.0 110.673 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.424 ' HZ3' ' HB3' ' A' ' 105' ' ' ALA . 43.4 m0 -61.16 -41.01 96.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.144 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -55.49 -46.05 76.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 109.881 172.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -68.5 -22.37 74.94 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.747 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 m -96.28 -68.25 0.81 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.924 0.392 . . . . 0.0 111.858 -179.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.42 ' N ' HD12 ' A' ' 88' ' ' LEU . 7.3 mp -63.88 -45.89 87.36 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.85 -172.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -76.82 -0.39 23.78 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.769 0.318 . . . . 0.0 111.542 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -88.29 -36.09 16.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.28 -10.34 59.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.699 171.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 57.7 71.4 0.58 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.636 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -89.17 161.18 16.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.734 175.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -87.32 27.11 1.11 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.058 -177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.579 HG12 ' HG ' ' A' ' 109' ' ' LEU . 29.5 m -86.53 132.94 31.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.298 0.571 . . . . 0.0 111.219 -176.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -99.95 118.71 36.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 173.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.759 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -127.13 140.86 51.96 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.832 -172.106 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -125.77 147.03 49.52 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.492 176.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.4 tt -112.76 98.36 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.538 0.685 . . . . 0.0 109.638 177.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.8 p -149.16 138.66 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.669 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 77.97 102.46 0.19 Allowed Glycine 0 C--O 1.226 -0.363 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.417 ' HA ' HG21 ' A' ' 77' ' ' THR . 14.0 m -49.32 -32.37 11.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -173.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.836 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 10.3 p-10 -74.48 -16.81 60.84 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -177.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 53.9 mtt85 -134.44 156.4 48.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.88 0.848 . . . . 0.0 112.922 -169.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.424 ' HB3' ' HZ3' ' A' ' 84' ' ' TRP . . . -135.77 142.29 44.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 107.703 163.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 4.4 tt -117.15 137.39 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.54 -172.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -131.69 142.27 49.78 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.6 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.444 ' HG2' ' HE3' ' A' ' 63' ' ' MET . 70.6 mtp -127.51 119.65 26.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 177.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.579 ' HG ' HG12 ' A' ' 95' ' ' VAL . 5.0 mp -98.91 119.89 38.43 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.37 -32.65 58.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 175.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -112.64 111.55 22.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.593 169.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -85.3 22.94 8.99 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.309 -0.472 . . . . 0.0 112.642 -178.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -60.57 -49.06 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.993 0.425 . . . . 0.0 110.874 -179.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.405 ' O ' HG22 ' A' ' 118' ' ' ILE . 40.2 p90 -97.36 29.96 3.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.735 -178.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.54 ' O ' ' HE1' ' A' ' 64' ' ' MET . . . -56.12 -53.01 62.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.732 -178.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -75.54 -22.02 57.41 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.17 -177.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -68.3 -56.04 10.0 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 175.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.661 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.4 tt -59.47 -41.55 84.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.796 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.499 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 65.7 tttm -55.06 -48.58 73.29 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.917 0.389 . . . . 0.0 110.337 177.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.04 -46.64 85.02 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.277 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -61.84 -41.29 97.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.47 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 78.7 mt -61.58 -41.2 97.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.664 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 27.7 m -87.29 -4.83 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.575 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.3 m -70.48 2.4 4.0 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.51 0.324 . . . . 0.0 111.736 174.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.526 ' NE2' HG12 ' A' ' 80' ' ' ILE . 46.2 mt-30 -59.69 162.93 4.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.404 0.621 . . . . 0.0 111.777 -177.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -85.97 -42.76 13.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.091 -0.959 . . . . 0.0 108.789 176.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -71.04 -22.82 62.09 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.478 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.3 m 72.86 137.39 0.05 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.919 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -137.72 156.08 48.39 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.542 -178.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -109.24 130.48 55.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.007 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.442 HG22 HG13 ' A' ' 66' ' ' VAL . 58.2 t -109.22 124.36 65.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.896 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.469 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 40.3 p -102.93 137.38 41.21 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 174.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 62' ' ' LEU . 50.1 mt -102.22 149.77 23.97 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.421 -172.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.589 ' HB3' ' HB2' ' A' ' 63' ' ' MET . 3.2 tm-20 . . . . . 0 C--O 1.234 0.266 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.46 ' O ' HG12 ' A' ' 3' ' ' ILE . 12.7 tt . . . . . 0 CA--C 1.537 0.45 0 CA-C-O 121.516 0.674 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -58.86 -49.72 76.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.93 -173.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -58.52 -42.69 88.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.469 -176.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.29 -48.83 80.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.077 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.621 ' HA ' ' SD ' ' A' ' 11' ' ' MET . 21.9 m-80 -60.38 -69.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.982 -179.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -49.53 -66.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.17 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.71 -60.37 3.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.914 -172.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -70.7 -44.54 66.72 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.155 0.502 . . . . 0.0 110.788 -169.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.621 ' SD ' ' HA ' ' A' ' 7' ' ' ASN . 71.0 mtp -74.51 -34.71 63.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.749 -172.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.54 -34.55 76.04 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.859 173.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 -62.8 -39.24 93.66 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.756 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.406 ' CD1' HD22 ' A' ' 15' ' ' LEU . 2.9 pp -84.05 -32.04 25.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.035 179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 11' ' ' MET . 3.5 mm? -69.28 -22.6 63.8 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.773 0.321 . . . . 0.0 110.273 174.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -48.8 -39.38 25.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.289 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -60.16 -46.32 90.07 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.347 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.484 ' CH2' ' HG3' ' A' ' 108' ' ' MET . 57.9 m95 -60.79 -42.14 96.98 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.179 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.06 -47.36 86.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.566 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.5 tttt -62.99 -34.21 77.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.51 178.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.19 -54.22 48.45 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.453 0.168 . . . . 0.0 111.117 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.5 p-10 -70.65 -26.71 63.58 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.093 -178.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 11.5 m-20 -62.3 -48.43 79.91 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.071 0.462 . . . . 0.0 110.472 172.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 20' ' ' LYS . 80.7 mt -59.66 -40.39 82.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.753 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -67.53 -30.73 70.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.399 178.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 74.3 mm-40 -60.43 -15.37 25.82 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 110.447 171.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.22 34.65 6.63 Favored Glycine 0 C--N 1.333 0.377 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.414 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -158.66 149.76 20.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.758 0.313 . . . . 0.0 110.247 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.437 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' MET . . . . . 0.402 ' SD ' HD12 ' A' ' 15' ' ' LEU . 32.5 mtm -132.45 128.71 38.06 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 169.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 60.2 mtt -110.48 122.43 47.7 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.929 0.395 . . . . 0.0 112.049 -171.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -95.62 106.68 18.8 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 169.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.407 HG21 HD13 ' A' ' 122' ' ' LEU . 23.3 t -99.67 112.83 33.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.67 0.272 . . . . 0.0 110.768 -174.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.81 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 25.8 m -85.48 109.66 18.64 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.616 HG11 HG21 ' A' ' 80' ' ' ILE . 42.7 t -94.66 -62.97 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 111.641 -171.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 52.8 p -93.6 -48.06 6.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.201 -173.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 77.66 9.24 87.01 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -165.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -126.22 129.22 24.27 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 123.618 0.767 . . . . 0.0 109.342 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.477 ' O ' ' HB3' ' A' ' 102' ' ' SER . 47.8 Cg_endo -65.64 -18.45 58.87 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.18 2.587 . . . . 0.0 114.816 -169.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.442 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.7 m -63.93 123.69 19.61 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.216 0.462 . . . . 0.0 110.944 -175.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -50.66 -29.04 10.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.759 0.824 . . . . 0.0 112.711 -175.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HG3' HG22 ' A' ' 73' ' ' THR . 25.2 mtpp -38.06 -60.74 0.72 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.447 0.699 . . . . 0.0 112.702 -176.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.98 -59.07 6.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.738 -171.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.6 t -60.65 -43.03 98.09 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 123.119 0.262 . . . . 0.0 110.999 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.83 -61.91 2.26 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.957 0.408 . . . . 0.0 111.081 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.1 -50.22 74.22 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.053 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.616 HG21 HG11 ' A' ' 68' ' ' VAL . 7.5 tp -64.45 -41.81 93.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.673 -173.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -66.34 -34.37 77.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.692 0.282 . . . . 0.0 110.652 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 85' ' ' GLN . 22.7 t -60.8 -43.45 98.14 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.331 0.586 . . . . 0.0 109.545 174.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.2 mt -64.29 -37.25 86.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.161 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' TRP . . . . . 0.586 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 46.3 m0 -67.11 -29.28 68.98 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.419 178.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.501 ' HB3' ' O ' ' A' ' 82' ' ' SER . 30.8 tt0 -62.51 -55.21 29.67 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.2 -26.95 51.31 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.429 -0.805 . . . . 0.0 113.432 175.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.3 m -86.87 -70.39 0.61 Allowed 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.387 -0.478 . . . . 0.0 111.411 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -53.6 -50.2 66.14 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -173.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.44 ' CD2' ' HA ' ' A' ' 85' ' ' GLN . 57.0 m-85 -77.25 -24.15 51.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -170.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -82.38 -19.97 38.11 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.73 10.41 7.65 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.565 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 74.79 15.1 3.23 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.729 0.812 . . . . 0.0 112.486 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -89.79 153.88 20.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -149.19 77.44 1.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.579 0.704 . . . . 0.0 110.039 176.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 29.4 m -89.36 176.59 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.831 174.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.813 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 5.8 tp60 -100.3 133.77 44.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 173.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.61 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.04 133.28 35.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.93 -164.524 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.417 ' O ' HG22 ' A' ' 106' ' ' ILE . 77.4 m-85 -137.85 132.66 32.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 176.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -89.14 88.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.816 0.817 . . . . 0.0 109.298 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -136.96 137.9 46.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.777 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.96 102.09 1.13 Allowed Glycine 0 C--O 1.222 -0.618 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -166.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 15.5 m -46.9 -36.11 7.2 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.444 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 16.9 p-10 -101.18 9.84 41.48 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.81 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 86.3 mtt85 -142.96 159.87 41.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.635 0.731 . . . . 0.0 112.34 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.53 144.69 51.57 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.0 168.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.417 HG22 ' O ' ' A' ' 98' ' ' PHE . 13.2 tt -114.76 141.64 30.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 120.999 0.428 . . . . 0.0 111.189 -177.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -135.21 106.87 6.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.165 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.813 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.3 OUTLIER -93.47 121.6 35.03 Favored 'General case' 0 C--O 1.243 0.752 0 CA-C-O 121.339 0.59 . . . . 0.0 110.118 176.12 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.443 ' N ' HD12 ' A' ' 109' ' ' LEU . 5.5 mp -105.45 120.98 42.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.153 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -54.66 15.61 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -112.51 111.4 22.2 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.42 174.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.27 56.6 4.77 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.249 -0.5 . . . . 0.0 113.183 -175.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.6 m -69.05 -29.38 67.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.868 0.366 . . . . 0.0 111.162 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -124.6 29.32 6.3 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.27 0.557 . . . . 0.0 110.905 -177.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.72 -43.11 90.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.716 -178.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 16.6 m95 -72.55 -34.43 67.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.724 -175.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.88 -51.29 65.27 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.506 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.554 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.1 tt -63.09 -38.64 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 178.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 23.2 ttpp -53.04 -57.99 8.5 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.126 0.488 . . . . 0.0 110.623 176.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.691 ' HA ' HG22 ' A' ' 123' ' ' VAL . 33.2 m-20 -68.18 -26.56 65.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.211 -176.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -65.21 -43.07 92.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.8 mt -72.69 -37.75 67.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.61 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' HA ' ' A' ' 120' ' ' ASP . 14.1 m -73.37 -26.03 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.803 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 18.7 t -85.61 3.69 39.66 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.74 176.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.586 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 6.3 tp-100 -65.54 158.64 26.49 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.937 -170.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.7 -68.7 0.28 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.722 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -73.09 4.86 3.87 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.553 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.5 m 71.42 149.54 0.09 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.317 0.647 . . . . 0.0 111.398 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 68' ' ' VAL . . . -171.05 103.76 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.402 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -91.27 130.92 37.08 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.301 0.572 . . . . 0.0 110.515 -179.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 45.5 t -92.01 144.26 9.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.443 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 85.9 m -124.99 136.11 53.42 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 90.6 mt -96.51 125.87 41.3 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 110.573 -174.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.236 0.353 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.479 ' O ' ' HB2' ' A' ' 2' ' ' ASP . . . . . . . . 0 N--CA 1.485 1.905 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 1' ' ' GLY . 18.1 t70 161.32 123.65 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 -172.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.455 HD13 ' HB2' ' A' ' 103' ' ' ASP . 0.6 OUTLIER 72.62 -28.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.517 0.727 . . . . 0.0 112.649 174.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.8 mtt180 -54.57 -22.68 13.92 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.684 0.278 . . . . 0.0 111.625 -176.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -58.36 -45.14 88.81 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.936 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.518 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -67.95 -40.66 83.2 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.676 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.559 ' O ' ' HB2' ' A' ' 11' ' ' MET . 81.0 m-20 -51.12 -69.05 0.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.641 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -53.49 -64.23 0.89 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.295 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.56 -58.69 4.26 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.302 -172.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.506 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 5.8 m-20 -70.17 -34.69 73.3 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -171.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.559 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 29.8 mmt -68.96 -41.55 77.84 Favored 'General case' 0 C--O 1.227 -0.132 0 C-N-CA 119.691 -0.804 . . . . 0.0 109.243 176.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.05 -49.75 68.29 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.966 0.412 . . . . 0.0 110.424 176.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.1 mtm180 -66.49 -39.56 88.8 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.298 -177.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.497 HD21 ' HD2' ' A' ' 98' ' ' PHE . 57.4 tp -66.9 -51.46 55.07 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.877 0.37 . . . . 0.0 110.891 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.542 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -69.99 -29.48 66.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.259 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -56.29 -34.98 66.98 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.061 0.458 . . . . 0.0 110.169 177.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -62.19 -53.02 61.23 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.89 175.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 53.9 m95 -57.74 -36.14 71.67 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.987 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -61.5 -50.04 74.3 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 175.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.513 ' O ' HG13 ' A' ' 24' ' ' ILE . 31.8 ttmt -65.4 -35.24 80.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.343 -177.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -66.22 -44.93 82.42 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.867 0.365 . . . . 0.0 110.043 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -61.63 -33.5 74.05 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.894 175.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.27 -42.1 72.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.952 175.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 20' ' ' LYS . 71.5 mt -61.11 -36.6 73.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -70.09 -35.1 73.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.482 175.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -60.88 -24.63 66.1 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.26 24.36 22.14 Favored Glycine 0 C--N 1.332 0.342 0 CA-C-N 115.458 -0.792 . . . . 0.0 114.042 174.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -159.17 156.8 29.63 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 117.062 0.431 . . . . 0.0 110.454 172.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.371 -178.164 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 46.4 mt . . . . . 0 N--CA 1.468 0.443 0 CA-C-O 121.385 0.612 . . . . 0.0 112.098 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.542 ' SD ' HD12 ' A' ' 15' ' ' LEU . 55.1 mtm -138.12 145.34 41.51 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 170.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.544 ' HG2' HD23 ' A' ' 133' ' ' LEU . 64.3 mtt -128.37 134.2 48.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.886 0.374 . . . . 0.0 111.829 -170.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 134' ' ' GLU . 43.7 m-85 -98.03 121.65 40.21 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 166.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 39.3 t -116.38 104.16 16.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.595 0.236 . . . . 0.0 110.777 -174.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.473 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 86.9 m -72.41 107.66 5.1 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 174.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.757 HG11 HG21 ' A' ' 80' ' ' ILE . 42.3 t -101.09 -62.92 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.718 0.294 . . . . 0.0 111.204 -173.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 46.7 m -92.62 -45.81 7.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.867 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.66 10.69 67.71 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 110.799 -0.921 . . . . 0.0 110.799 -169.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.488 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 30.3 t30 -126.11 129.23 24.29 Favored Pre-proline 0 C--N 1.331 -0.237 0 C-N-CA 123.615 0.766 . . . . 0.0 109.096 -177.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.488 ' HD2' ' OD1' ' A' ' 71' ' ' ASN . 13.8 Cg_endo -55.15 -18.15 17.02 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.549 2.833 . . . . 0.0 114.225 -176.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 75' ' ' LYS . 24.4 m -58.77 93.06 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.919 0.39 . . . . 0.0 111.611 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.461 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 2.6 mp0 -50.81 -23.66 2.92 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.907 -0.588 . . . . 0.0 112.289 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.58 ' HD2' ' N ' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -59.61 -41.22 89.88 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.757 -174.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -61.26 -53.53 55.6 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.679 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.519 ' HA ' HG22 ' A' ' 80' ' ' ILE . 17.5 m -62.77 -32.88 74.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.58 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.54 -60.09 4.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.316 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 42.0 mt-10 -55.71 -55.82 27.71 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.575 0.703 . . . . 0.0 110.867 -178.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.757 HG21 HG11 ' A' ' 68' ' ' VAL . 10.7 tp -65.1 -48.93 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.073 -171.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.489 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 89.8 m -63.56 -29.83 71.03 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 122.244 -0.285 . . . . 0.0 110.662 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.3 t -59.41 -46.68 88.04 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 174.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.512 HD12 HD12 ' A' ' 80' ' ' ILE . 55.6 mt -58.39 -48.48 80.48 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.092 175.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.512 ' NE1' HG13 ' A' ' 80' ' ' ILE . 28.7 m0 -59.27 -39.45 82.93 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.098 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.5 mt-30 -64.68 -58.06 7.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 177.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -53.42 -22.26 15.38 Favored Glycine 0 CA--C 1.522 0.526 0 CA-C-N 115.71 -0.677 . . . . 0.0 113.91 176.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 31.9 m -88.39 -61.72 1.65 Allowed 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 117.453 0.627 . . . . 0.0 111.306 178.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.58 -47.51 78.45 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.808 -173.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.416 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 71.3 m-85 -78.69 1.12 24.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.276 -176.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 48.8 t30 -89.34 -37.6 14.77 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 177.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.44 2.36 48.03 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.637 176.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.4 t30 60.87 89.32 0.08 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.268 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 17.6 m-30 -114.93 140.44 49.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.531 174.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -73.66 66.67 1.08 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.081 0.467 . . . . 0.0 110.408 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 26.9 m -134.71 163.51 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.832 -177.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -139.96 148.83 42.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 173.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.609 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -133.76 137.58 45.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.523 0.202 . . . . 0.0 110.591 -173.531 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.497 ' HD2' HD21 ' A' ' 14' ' ' LEU . 22.9 m-85 -124.77 136.28 53.72 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.3 tt -109.04 89.95 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.463 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.3 p -132.07 125.37 54.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.254 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.518 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 70.91 100.99 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.126 -174.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.461 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 3.0 m -56.61 -14.88 3.56 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -173.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.455 ' HB2' HD13 ' A' ' 3' ' ' ILE . 19.7 t70 -57.57 -51.36 69.78 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 46.2 mtt180 -134.36 132.39 39.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.614 -174.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -96.21 136.95 35.99 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 168.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.628 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.9 tt -105.62 136.95 37.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.131 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.434 ' CZ ' ' HE3' ' A' ' 84' ' ' TRP . 25.3 m-85 -132.09 116.98 17.73 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.022 -176.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.628 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.1 mpp? -100.45 121.03 40.88 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.451 ' N ' HD12 ' A' ' 109' ' ' LEU . 4.9 mp -104.31 119.74 39.64 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.455 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 19.0 mmm-85 -82.36 -16.17 50.15 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -126.72 126.35 43.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.613 174.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.73 10.53 59.04 Favored Glycine 0 CA--C 1.518 0.255 0 C-N-CA 121.137 -0.554 . . . . 0.0 113.502 -175.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.1 m -63.72 -50.53 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.247 0.524 . . . . 0.0 110.319 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -91.93 24.59 3.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.681 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.28 -53.95 52.43 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.087 0.47 . . . . 0.0 111.313 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -71.71 -17.08 62.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.824 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -74.91 -49.96 18.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.241 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 5.1 tt -62.97 -44.91 99.93 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -55.15 -45.43 75.68 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.478 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -59.47 -42.95 93.21 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.351 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.01 -39.27 89.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.623 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 33.5 mt -68.51 -38.12 80.64 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.175 -178.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 18.8 m -84.28 -16.88 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.24 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.1 t -75.53 1.57 13.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.399 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -87.71 160.54 18.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.875 0.369 . . . . 0.0 111.53 -173.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -52.48 -66.8 0.32 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.427 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 57.0 mtm180 -71.94 -21.37 61.62 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.894 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.8 m 68.68 134.14 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.167 0.587 . . . . 0.0 111.581 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.441 ' HB3' ' HB3' ' A' ' 122' ' ' LEU . . . -100.65 147.56 25.84 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.423 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.473 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 38.7 mt-10 -99.83 117.72 34.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.113 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 29.9 t -110.01 134.15 53.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.384 -172.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 24.1 p -137.72 145.73 42.88 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.622 ' HB2' ' HG2' ' A' ' 137' ' ' MET . 79.1 mt -86.51 158.9 19.45 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.636 0.255 . . . . 0.0 110.654 -178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -76.57 141.3 41.18 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.93 -179.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 70.8 -80.46 0.45 Allowed Glycine 0 CA--C 1.518 0.275 0 CA-C-N 116.329 -0.396 . . . . 0.0 112.901 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -132.68 152.67 51.63 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 122.754 0.422 . . . . 0.0 110.467 -176.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.622 ' HG2' ' HB2' ' A' ' 133' ' ' LEU . 73.3 mtp -115.54 142.35 46.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.133 177.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.441 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 84.3 m-85 -76.35 -43.85 3.43 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.879 176.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.441 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 76.2 Cg_endo -83.03 149.23 13.63 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 122.102 1.868 . . . . 0.0 112.016 173.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 78.55 42.6 13.69 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 121.174 -0.536 . . . . 0.0 112.31 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 96.5 mttt . . . . . 0 C--O 1.234 0.285 0 N-CA-C 110.521 -0.177 . . . . 0.0 110.521 178.581 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.73 0 N-CA-C 112.091 -0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -167.78 -41.26 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.168 0.509 . . . . 0.0 110.516 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.792 HG12 ' HB3' ' A' ' 6' ' ' TYR . 13.6 tt -111.03 35.26 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-O 122.028 0.918 . . . . 0.0 110.126 -175.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.518 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 72.0 ttt-85 -63.75 -24.11 67.63 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.006 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -62.21 -42.55 99.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.362 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.792 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -57.94 -47.06 84.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 173.374 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.527 ' O ' ' HB2' ' A' ' 11' ' ' MET . 22.2 m-80 -47.52 -70.63 0.09 Allowed 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.311 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -57.56 -61.95 2.13 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.996 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -57.24 -68.94 0.18 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.466 -174.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 4.5 m-20 -61.3 -48.69 80.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.257 -0.402 . . . . 0.0 112.07 -173.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.536 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 7.5 mmt -59.67 -46.38 89.22 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.273 -175.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.44 -45.22 80.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.006 0.431 . . . . 0.0 111.251 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 86.8 mtt180 -68.86 -26.75 65.29 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.255 -174.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 15' ' ' LEU . 4.4 pp -89.25 -29.57 19.13 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.369 175.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 11' ' ' MET . 0.1 OUTLIER -63.71 -30.94 71.98 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 175.469 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -48.16 -42.06 28.54 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.914 177.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -62.1 -52.54 63.45 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.403 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.522 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 48.0 m95 -62.35 -39.4 92.98 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.376 -176.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -62.69 -48.22 80.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.654 176.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.535 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.3 tttt -62.11 -48.0 82.13 Favored 'General case' 0 C--O 1.225 -0.191 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.032 -178.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -44.93 86.93 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.132 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -57.6 -45.14 85.66 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.073 0.463 . . . . 0.0 110.04 176.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -62.2 -41.52 98.44 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.954 177.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 20' ' ' LYS . 91.1 mt -60.59 -40.86 85.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 121.196 0.522 . . . . 0.0 109.999 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -67.19 -31.61 72.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.503 -0.772 . . . . 0.0 110.813 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.33 -10.65 17.33 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.324 0.583 . . . . 0.0 110.198 172.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.93 33.02 7.57 Favored Glycine 0 CA--C 1.518 0.227 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.991 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -159.46 147.23 17.27 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 171.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.8 mm? . . . . . 0 C--O 1.235 0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.013 -175.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.626 HD11 HD22 ' A' ' 133' ' ' LEU . 44.2 tp . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.498 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 79.8 mtp -135.08 135.11 40.98 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 166.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.527 ' SD ' HD11 ' A' ' 109' ' ' LEU . 86.9 mtp -115.84 119.38 35.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.845 0.355 . . . . 0.0 111.397 -171.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 49.6 m-85 -95.16 123.18 38.52 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.454 HG21 HD13 ' A' ' 122' ' ' LEU . 43.2 t -124.04 109.06 21.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 117.794 0.27 . . . . 0.0 110.939 -173.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.466 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 28.3 m -74.0 98.49 3.07 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.641 HG11 HG21 ' A' ' 80' ' ' ILE . 11.4 t -87.63 -58.42 3.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.296 -171.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.614 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 34.7 t -89.92 -58.87 2.36 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.993 -174.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 88.41 -10.76 70.27 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -171.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.559 HD21 HG23 ' A' ' 73' ' ' THR . 11.4 t30 -122.98 132.62 24.27 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 122.938 0.495 . . . . 0.0 109.7 178.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 49.4 Cg_exo -56.99 -16.17 19.76 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.139 3.226 . . . . 0.0 115.639 -172.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.559 HG23 HD21 ' A' ' 71' ' ' ASN . 18.8 p -52.26 110.68 0.52 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.467 0.576 . . . . 0.0 112.16 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.423 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 35.8 mt-10 -55.15 -23.95 23.99 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.715 179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -42.39 -62.45 0.96 Allowed 'General case' 0 C--O 1.241 0.625 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.006 176.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.408 ' O ' HG22 ' A' ' 80' ' ' ILE . 9.5 mm-40 -56.67 -55.46 33.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.195 -172.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' ' 102' ' ' SER . 11.5 t -63.6 -46.18 86.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.694 -173.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.401 ' N ' HG23 ' A' ' 77' ' ' THR . 37.3 tt0 -61.05 -49.35 77.72 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.886 0.375 . . . . 0.0 110.182 -177.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -62.62 -52.79 61.97 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.475 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.641 HG21 HG11 ' A' ' 68' ' ' VAL . 10.9 tp -67.16 -41.73 87.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.228 -174.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.9 m -66.53 -31.04 71.5 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.673 0.273 . . . . 0.0 110.536 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -63.64 -46.52 85.32 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 172.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 90.8 mt -59.66 -37.5 78.91 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.35 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.552 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 48.6 m0 -64.4 -44.35 91.56 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.484 177.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.51 -59.53 4.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.57 -62.16 4.2 Favored Glycine 0 CA--C 1.522 0.477 0 CA-C-N 115.806 -0.633 . . . . 0.0 113.139 175.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.1 m -58.84 -57.34 13.47 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.36 -46.69 89.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.929 0.395 . . . . 0.0 111.458 -174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -72.35 -27.84 62.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.125 -177.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -75.7 -28.19 58.53 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.044 0.45 . . . . 0.0 110.064 177.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 3.63 51.98 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.287 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.3 t30 62.76 75.94 0.38 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.672 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -107.67 122.17 46.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.086 169.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -81.24 26.49 0.45 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.227 0.537 . . . . 0.0 110.617 -176.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.1 m -92.05 157.44 2.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.906 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -112.85 154.97 25.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 170.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.407 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -146.95 138.15 24.05 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.553 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -122.11 151.5 40.85 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.867 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -121.14 90.2 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.636 0.731 . . . . 0.0 110.697 -175.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.9 p -128.82 129.64 68.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 174.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.415 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 80.67 101.32 0.32 Allowed Glycine 0 C--O 1.226 -0.378 0 N-CA-C 110.433 -1.067 . . . . 0.0 110.433 -170.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.5 ' O ' ' HB ' ' A' ' 77' ' ' THR . 15.3 m -62.55 -9.11 7.67 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -169.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.614 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 16.1 p-10 -96.42 -18.98 19.52 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 122.113 -0.367 . . . . 0.0 111.335 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.493 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 49.9 ttt180 -137.88 132.27 32.24 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.983 -172.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.22 153.51 22.04 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.423 HG23 ' HE1' ' A' ' 108' ' ' MET . 11.3 tt -124.93 136.27 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-O 120.844 0.354 . . . . 0.0 111.269 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 64' ' ' MET . 13.4 m-85 -117.96 139.02 51.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.751 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.522 ' HG2' ' CH2' ' A' ' 18' ' ' TRP . 1.5 mpt? -109.96 115.92 30.67 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.604 178.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.56 HD12 HD23 ' A' ' 62' ' ' LEU . 15.4 mt -126.23 103.4 7.66 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.495 0.497 . . . . 0.0 111.502 -174.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mtp-105 -99.26 5.61 46.57 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 122.076 0.941 . . . . 0.0 108.502 165.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -146.85 124.09 11.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.026 -1.443 . . . . 0.0 107.674 172.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.63 57.17 0.25 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 119.805 -1.188 . . . . 0.0 113.808 -173.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.4 t -66.36 -25.97 67.05 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -96.79 24.02 6.5 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.373 177.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.32 -49.94 72.86 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.204 0.526 . . . . 0.0 111.321 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.509 ' HH2' HD11 ' A' ' 133' ' ' LEU . 0.6 OUTLIER -76.62 -26.88 55.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.762 -179.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.06 -48.73 75.1 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 120.886 0.374 . . . . 0.0 110.297 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.62 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 15.0 tt -67.33 -39.02 81.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 177.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -55.13 -46.6 75.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.457 175.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.5 ' HA ' HG22 ' A' ' 123' ' ' VAL . 37.5 m-20 -61.95 -41.37 97.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.471 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -59.66 -38.44 81.46 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.099 0.476 . . . . 0.0 110.399 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 70.9 mt -69.82 -47.81 61.39 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.5 HG22 ' HA ' ' A' ' 120' ' ' ASP . 24.9 m -73.28 -18.72 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.718 0.294 . . . . 0.0 111.476 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 24.7 t -71.53 0.91 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.498 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.552 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 45.8 mt-30 -76.87 162.85 27.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.74 0.781 . . . . 0.0 112.715 -174.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.65 8.79 1.3 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.345 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 80.9 mtt-85 -121.14 -18.26 7.5 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 122.373 0.269 . . . . 0.0 110.882 -171.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 52.9 t 57.59 71.75 0.56 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.357 0.599 . . . . 0.0 109.984 -172.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -73.52 130.21 39.6 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.028 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.466 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 42.7 mt-10 -81.26 114.04 19.79 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.252 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 67.3 t -95.53 128.08 47.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.5 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 33.8 p -133.08 145.28 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 137' ' ' MET . 60.7 mt -102.13 168.87 9.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 110.978 -174.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.557 ' HA ' ' HE2' ' A' ' 65' ' ' PHE . 36.1 tt0 -55.13 98.77 0.02 OUTLIER 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.141 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.81 -61.35 4.05 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.587 177.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -143.33 147.11 34.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.738 0.304 . . . . 0.0 110.681 -175.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.725 ' HA ' HD12 ' A' ' 133' ' ' LEU . 83.0 mtp -76.5 110.42 11.03 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 172.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.592 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 42.8 p90 -59.63 -33.29 15.43 Favored Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -175.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.592 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 33.8 Cg_endo -66.04 -24.59 52.3 Favored 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 121.222 1.281 . . . . 0.0 112.072 174.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 82.85 -66.25 3.97 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.369 -177.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 C--O 1.235 0.319 0 C-N-CA 122.41 0.284 . . . . 0.0 110.672 -175.44 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.785 ' HB3' ' HG3' ' A' ' 4' ' ' ARG . 1.3 m-20 -101.0 151.79 21.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.993 0.425 . . . . 0.0 110.842 -176.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.502 HD11 ' HA2' ' A' ' 101' ' ' GLY . 12.8 tt -96.85 15.7 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 121.579 0.704 . . . . 0.0 109.988 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.785 ' HG3' ' HB3' ' A' ' 2' ' ' ASP . 92.8 mtt180 -57.96 -31.61 67.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.009 -176.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -56.45 -50.34 71.97 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.938 -0.573 . . . . 0.0 109.976 -179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.02 -47.17 86.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.993 176.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.58 ' O ' ' HB2' ' A' ' 11' ' ' MET . 91.7 m-20 -52.34 -74.93 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.961 -179.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -51.65 -66.34 0.4 Allowed 'General case' 0 C--O 1.24 0.595 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.92 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -57.34 8.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.885 -169.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -76.26 -37.76 57.15 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.111 -168.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.58 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 11.1 mmt -67.79 -40.86 83.88 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 120.156 -0.618 . . . . 0.0 109.728 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.9 -52.28 66.14 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 121.212 0.53 . . . . 0.0 110.158 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -63.42 -32.37 73.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.858 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.7 tp -77.38 -52.52 9.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.819 0.343 . . . . 0.0 110.801 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.407 ' N ' HD22 ' A' ' 15' ' ' LEU . 3.5 mm? -77.05 -10.23 59.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.995 -177.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -47.98 -53.78 15.0 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.996 175.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.18 -37.73 88.53 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.254 -177.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -61.22 -42.17 98.13 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.028 0.442 . . . . 0.0 110.764 -177.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -69.52 -41.24 76.29 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.498 ' O ' HG13 ' A' ' 24' ' ' ILE . 59.1 tttp -54.15 -50.36 67.14 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.093 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.2 -54.39 47.43 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.01 178.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -52.95 -41.71 64.76 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.176 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -65.93 -44.97 83.57 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.644 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.4 mt -61.98 -34.69 64.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 120.856 0.36 . . . . 0.0 110.39 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -69.13 -38.74 79.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.308 177.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -63.49 -21.32 66.25 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.369 0.604 . . . . 0.0 109.658 170.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.98 17.78 46.22 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.304 178.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -113.8 109.14 18.07 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 176.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.455 HD13 HG12 ' A' ' 24' ' ' ILE . 3.8 mm? . . . . . 0 C--N 1.329 -0.298 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 175.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 109' ' ' LEU . 1.5 tm? . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 121.378 0.609 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.474 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 8.8 ptm -147.19 113.58 5.94 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.225 174.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.574 ' HE2' HD21 ' A' ' 62' ' ' LEU . 62.5 mtt -117.42 141.29 48.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.815 -170.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.481 ' HE2' ' HG2' ' A' ' 134' ' ' GLU . 51.9 m-85 -107.03 122.08 45.75 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 168.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.8 t -110.62 102.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 110.933 -174.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.726 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 37.1 m -77.15 100.34 5.72 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 172.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.467 HG11 HG21 ' A' ' 80' ' ' ILE . 50.4 t -80.34 -63.64 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.153 -171.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.534 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 38.7 t -93.24 -55.39 3.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.127 0.489 . . . . 0.0 112.233 -172.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.612 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 90.86 -10.27 75.39 Favored Glycine 0 N--CA 1.451 -0.329 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 -167.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.505 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 34.6 t30 -107.79 126.61 29.46 Favored Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 176.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.567 ' O ' ' HB2' ' A' ' 102' ' ' SER . 19.0 Cg_endo -56.62 -16.45 19.12 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.6 2.867 . . . . 0.0 114.42 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.681 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.1 m -61.66 95.61 0.05 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.291 0.567 . . . . 0.0 110.468 -177.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -44.94 -31.01 1.12 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.571 1.148 . . . . 0.0 113.918 -172.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.681 ' HG3' HG22 ' A' ' 73' ' ' THR . 0.0 OUTLIER -51.76 -34.61 40.2 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 -175.598 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.612 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 5.6 mm-40 -58.23 -55.66 32.17 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.02 0.438 . . . . 0.0 111.023 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 57.6 m -65.21 -34.73 79.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.923 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -60.62 -51.65 68.48 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.722 0.296 . . . . 0.0 110.341 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 75' ' ' LYS . 50.3 mt-10 -55.79 -54.11 48.47 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.33 0.586 . . . . 0.0 110.079 178.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.488 HD12 HD12 ' A' ' 83' ' ' LEU . 2.6 tp -62.15 -42.36 94.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.146 -172.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 72.6 m -64.67 -39.2 93.27 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.629 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 59.2 m -62.66 -40.28 96.56 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 120.838 0.351 . . . . 0.0 110.339 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.488 HD12 HD12 ' A' ' 80' ' ' ILE . 86.6 mt -60.89 -50.09 74.81 Favored 'General case' 0 CA--C 1.523 -0.091 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.686 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.9 m0 -60.61 -31.7 70.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.036 -178.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.582 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 35.3 tt0 -62.75 -63.36 1.24 Allowed 'General case' 0 C--O 1.235 0.327 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 173.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -59.49 -13.68 24.22 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.634 -0.712 . . . . 0.0 114.025 178.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.6 m -96.55 -71.36 0.68 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.376 0.588 . . . . 0.0 111.743 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 9.4 mp -56.42 -54.96 39.48 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.342 -174.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.582 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 91.8 m-85 -72.02 -14.32 61.85 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.358 -173.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -78.62 -32.7 47.58 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.46 11.74 22.98 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.672 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 72.65 25.7 2.56 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.359 0.664 . . . . 0.0 112.638 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 27.7 m-85 -81.99 81.77 7.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.64 82.49 3.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.239 0.542 . . . . 0.0 109.922 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.839 HG12 HD21 ' A' ' 109' ' ' LEU . 4.3 m -109.14 165.56 5.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.567 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.365 -177.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -101.5 136.54 41.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 174.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.623 ' HD3' ' N ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.33 142.22 23.83 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -172.805 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -127.27 127.74 44.86 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.6 tt -87.4 88.0 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 122.071 0.939 . . . . 0.0 109.125 173.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.78 134.58 38.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.119 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.502 ' HA2' HD11 ' A' ' 3' ' ' ILE . . . 100.4 104.7 2.67 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 110.241 -1.144 . . . . 0.0 110.241 -168.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.567 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 11.1 p -38.23 -51.92 1.47 Allowed 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -173.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.612 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 10.1 p-10 -102.11 8.16 40.83 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -175.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.726 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 54.4 mtt180 -137.04 140.8 42.31 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -170.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.58 143.85 46.5 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.641 173.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.645 HG12 ' SD ' ' A' ' 108' ' ' MET . 7.7 tt -112.34 139.56 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 120.741 0.305 . . . . 0.0 111.455 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -128.77 139.85 52.0 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.781 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.645 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.3 mpp? -135.14 143.19 46.4 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-O 121.049 0.452 . . . . 0.0 110.517 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.839 HD21 HG12 ' A' ' 95' ' ' VAL . 12.4 mt -138.44 151.98 47.92 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.366 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 110' ' ' ARG . 7.3 mmm180 -85.35 -33.02 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.589 176.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -112.73 152.9 28.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.163 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -118.34 27.39 7.33 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 121.273 -0.489 . . . . 0.0 112.474 -178.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -66.02 -69.25 0.31 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.019 0.438 . . . . 0.0 110.693 -179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.02 25.71 1.1 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.329 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.14 -38.76 92.46 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.824 -176.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -77.52 -31.29 53.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.362 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -67.45 -50.84 57.44 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.215 177.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 7.6 tt -62.72 -37.9 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 116.344 -0.389 . . . . 0.0 109.985 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.478 ' HD3' ' N ' ' A' ' 120' ' ' ASP . 12.2 tmtt? -56.48 -51.64 67.69 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.293 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.482 ' HA ' HG22 ' A' ' 123' ' ' VAL . 64.9 m-20 -62.15 -33.37 74.37 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.668 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -67.58 -42.79 81.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 178.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 94.5 mt -61.08 -41.65 97.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.482 HG22 ' HA ' ' A' ' 120' ' ' ASP . 20.6 m -79.06 -15.91 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 120.515 0.197 . . . . 0.0 111.246 179.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.5 t -64.87 2.17 0.76 Allowed 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.686 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -84.87 98.84 10.55 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.349 0.595 . . . . 0.0 110.174 -176.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -45.97 -51.24 13.73 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.467 -1.242 . . . . 0.0 113.582 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 30.9 mtm180 -55.79 -44.65 77.97 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.71 0.29 . . . . 0.0 111.482 -174.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 69' ' ' SER . 21.5 p 177.07 136.0 0.06 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.779 -178.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 125' ' ' GLN . . . -170.93 116.98 0.46 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.75 0.309 . . . . 0.0 111.171 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -137.03 127.61 26.89 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 10.8 p -123.9 143.97 35.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.729 0.3 . . . . 0.0 110.773 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 53.6 m -131.53 144.98 51.52 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 177.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.449 HD23 ' HG2' ' A' ' 64' ' ' MET . 64.1 mt -93.58 145.5 24.48 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.481 ' HG2' ' HE2' ' A' ' 65' ' ' PHE . 0.2 OUTLIER -82.19 140.11 33.91 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.23 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.09 -108.14 3.53 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 -176.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -148.32 173.02 13.48 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.536 0.334 . . . . 0.0 110.361 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 14.0 tpt -72.61 106.0 4.47 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.517 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 90.4 m-85 -71.72 -52.46 8.12 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -175.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.517 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 92.2 Cg_endo -80.56 124.1 5.08 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 121.872 1.714 . . . . 0.0 111.938 -178.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 90.23 102.4 1.16 Allowed Glycine 0 N--CA 1.451 -0.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.419 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.235 0.294 0 CA-C-O 120.826 0.346 . . . . 0.0 110.601 -179.922 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.94 0 N-CA-C 111.888 -0.485 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -141.61 -39.14 0.39 Allowed 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.985 0.421 . . . . 0.0 110.664 -175.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.626 HG21 ' HB3' ' A' ' 103' ' ' ASP . 12.1 tt -67.97 92.35 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.61 0.719 . . . . 0.0 110.657 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 60.7 mtt85 -109.58 -37.13 5.78 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.499 -175.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -56.31 -43.58 79.06 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.736 -178.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.448 ' HE1' HG13 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -55.21 -47.11 75.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.441 176.731 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.606 ' O ' ' HB2' ' A' ' 11' ' ' MET . 44.1 m-80 -60.88 -64.54 0.92 Allowed 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -50.36 -69.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.683 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.45 ' HB1' ' NH1' ' A' ' 13' ' ' ARG . . . -59.38 -64.4 0.96 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.042 -174.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.73 -46.49 65.81 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.863 -167.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.606 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 22.3 mmt -70.54 -38.51 74.22 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.938 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.32 -47.12 77.66 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.417 178.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.45 ' NH1' ' HB1' ' A' ' 9' ' ' ALA . 80.3 mtt180 -70.3 -26.79 63.95 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.885 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.6 tp -82.77 -52.28 6.9 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.907 176.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 4.1 mm? -73.1 -17.25 61.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.986 -174.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.5 OUTLIER -57.47 -32.97 67.5 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.102 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.96 -45.76 84.39 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.806 177.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -63.29 -41.21 98.96 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.912 -178.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 46.5 mt-10 -63.02 -43.13 99.59 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.394 0.616 . . . . 0.0 109.381 176.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 24' ' ' ILE . 26.4 ttpt -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.12 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -59.07 -44.93 91.92 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.319 0.58 . . . . 0.0 110.468 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.5 -37.24 86.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.32 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.33 -37.53 80.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.945 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 20' ' ' LYS . 85.8 mt -62.17 -38.53 81.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 174.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.87 -36.34 82.97 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.898 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -63.02 -15.07 55.17 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.738 173.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.99 24.77 26.4 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.682 177.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -134.7 132.0 38.33 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.406 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.5 mm? . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.574 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 C--O 1.235 0.302 0 CA-C-O 121.208 0.528 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 21.4 ptm -132.03 110.23 10.58 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.675 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 56.8 mtt -114.73 122.15 45.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.721 -169.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -88.38 117.83 27.57 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 168.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.532 HG21 HD13 ' A' ' 122' ' ' LEU . 39.5 t -114.43 104.75 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.588 0.232 . . . . 0.0 110.954 -173.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.732 HG23 ' HB2' ' A' ' 130' ' ' GLU . 1.6 t -84.96 122.37 29.11 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -85.35 -61.58 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.302 -174.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 30.9 t -92.88 -36.38 12.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.145 0.498 . . . . 0.0 111.127 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 86.94 7.52 77.61 Favored Glycine 0 N--CA 1.45 -0.382 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -168.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.456 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 7.7 t30 -126.63 139.98 36.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 114.66 -0.77 . . . . 0.0 109.802 -176.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -47.51 -16.23 0.41 Allowed 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.632 3.555 . . . . 0.0 116.586 -174.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.456 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 5.5 p -76.73 160.28 29.46 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.501 1.046 . . . . 0.0 110.869 -169.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.605 ' HG2' ' HG3' ' A' ' 78' ' ' GLU . 37.5 tt0 -104.08 -25.38 12.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.646 -166.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.754 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.58 -52.74 53.75 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.678 -171.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -45.37 -58.89 2.99 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.283 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.473 ' HA ' HG22 ' A' ' 80' ' ' ILE . 35.5 m -67.13 -35.97 80.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.856 -174.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.605 ' HG3' ' HG2' ' A' ' 74' ' ' GLU . 49.1 mt-10 -56.05 -60.17 3.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.09 176.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.431 ' O ' HD13 ' A' ' 83' ' ' LEU . 44.0 mt-10 -59.08 -54.02 51.82 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.899 -175.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.823 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.9 tp -62.36 -42.76 96.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.938 -174.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 91.7 m -64.0 -33.18 75.15 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.457 0.17 . . . . 0.0 111.063 176.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.1 m -63.04 -39.07 93.65 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 110.294 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.431 HD13 ' O ' ' A' ' 79' ' ' GLU . 10.4 mp -67.75 -48.28 66.86 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.539 174.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.717 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 43.7 m0 -55.87 -55.94 26.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.968 -179.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -57.33 -54.81 42.6 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.61 -29.16 3.93 Favored Glycine 0 C--N 1.333 0.393 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.273 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.6 m -91.79 -57.1 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 117.527 0.664 . . . . 0.0 111.284 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.3 mt -57.88 -48.62 79.3 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.667 -174.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -74.31 -22.49 59.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.979 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.6 t30 -73.62 -29.41 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 174.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.15 0.5 51.51 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.128 173.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 66.43 36.59 5.06 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.193 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -81.47 119.75 24.13 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -84.75 49.94 1.81 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.245 0.545 . . . . 0.0 111.199 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 33.9 m -87.99 150.21 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.433 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.0 tp60 -102.49 144.98 30.23 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.489 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -146.42 137.92 24.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.147 -177.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -127.45 123.14 35.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 175.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -93.74 88.12 2.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.997 0.903 . . . . 0.0 109.337 173.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.448 HG13 ' HE1' ' A' ' 6' ' ' TYR . 7.0 p -131.53 143.39 40.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.093 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.2 85.74 0.14 Allowed Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -169.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.9 m -30.21 -44.27 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 -167.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.626 ' HB3' HG21 ' A' ' 3' ' ' ILE . 13.2 t70 -69.18 -32.81 72.38 Favored 'General case' 0 C--O 1.241 0.649 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -172.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.493 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 93.0 mtt180 -122.46 134.17 54.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.296 0.57 . . . . 0.0 112.323 -171.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -102.65 132.68 48.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 170.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.532 HD12 ' SD ' ' A' ' 11' ' ' MET . 9.3 tt -104.65 129.68 56.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.041 0.448 . . . . 0.0 111.197 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -115.2 132.38 56.63 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.613 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -131.27 136.52 48.25 Favored 'General case' 0 C--O 1.244 0.798 0 CA-C-O 121.366 0.603 . . . . 0.0 110.993 177.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.491 HD21 HD12 ' A' ' 118' ' ' ILE . 4.6 mp -123.11 156.13 35.59 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.871 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -105.09 5.72 32.65 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -135.35 151.75 50.8 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.493 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -127.58 41.53 1.58 Allowed Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.054 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.8 m -93.6 -65.53 0.99 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.055 0.455 . . . . 0.0 110.113 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 117' ' ' GLU . 41.4 p90 -91.0 27.6 1.79 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.021 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.61 -48.1 73.4 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.74 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -68.58 -30.88 69.74 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.202 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.426 ' HB3' ' O ' ' A' ' 114' ' ' TYR . 5.1 tp10 -52.91 -49.71 65.39 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 172.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.619 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 25.1 mt -64.46 -45.41 95.86 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.126 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -58.17 7.32 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.317 0.58 . . . . 0.0 110.072 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.508 ' O ' ' HB2' ' A' ' 124' ' ' SER . 11.2 m-20 -61.38 -36.85 81.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.791 179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -63.36 -47.16 83.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.738 0.304 . . . . 0.0 110.381 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.5 mt -57.81 -45.9 85.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.815 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.525 HG12 ' O ' ' A' ' 129' ' ' ALA . 13.1 m -84.97 -6.75 10.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -177.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 120' ' ' ASP . 23.2 t -68.65 0.99 3.54 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.823 ' HG2' HD11 ' A' ' 80' ' ' ILE . 2.9 mp0 -96.04 155.7 16.65 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.602 -0.686 . . . . 0.0 110.633 -174.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -51.59 -51.68 53.56 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.873 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -67.18 -10.12 47.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.483 179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 63.4 m 66.08 -156.62 0.26 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.906 178.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.525 ' O ' HG12 ' A' ' 123' ' ' VAL . . . 173.23 126.77 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.732 ' HB2' HG23 ' A' ' 67' ' ' THR . 46.0 mt-10 -96.97 113.66 25.21 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.339 0.59 . . . . 0.0 110.331 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 51.9 t -98.99 135.94 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.282 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 28.4 m -127.1 112.75 15.54 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.675 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.6 mp -89.95 128.03 36.15 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -95.32 103.99 15.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.866 0.365 . . . . 0.0 110.109 176.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 155.9 -150.29 21.6 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.769 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -88.47 123.23 32.79 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.963 0.411 . . . . 0.0 110.376 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.502 ' HG3' ' HD2' ' A' ' 139' ' ' PRO . 0.1 OUTLIER -76.6 94.43 3.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.737 178.168 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.498 ' CG ' ' HD3' ' A' ' 139' ' ' PRO . 23.9 p90 -70.13 -30.91 2.1 Favored Pre-proline 0 CA--C 1.544 0.732 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.502 ' HD2' ' HG3' ' A' ' 137' ' ' MET . 21.2 Cg_exo -67.61 78.99 0.49 Allowed 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 121.582 1.522 . . . . 0.0 111.363 172.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 157.17 -172.11 34.61 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.858 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 95.7 mttt . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.82 0.343 . . . . 0.0 110.663 -179.139 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.802 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -110.08 153.7 24.29 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.852 0.358 . . . . 0.0 110.614 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.4 tt -111.5 0.37 9.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 173.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -52.25 -36.41 52.46 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.304 -177.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -58.6 -49.9 75.8 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.008 0.433 . . . . 0.0 110.4 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.4 -48.09 76.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.662 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.08 -62.01 1.76 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.635 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -57.71 -56.91 15.77 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.281 -176.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.93 -61.48 2.58 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.586 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.91 -54.87 41.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.162 -174.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.471 ' O ' HD23 ' A' ' 15' ' ' LEU . 6.2 mmt -58.01 -52.39 65.72 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-O 120.599 0.238 . . . . 0.0 110.904 -176.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.55 -50.18 74.89 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.019 0.438 . . . . 0.0 111.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -77.41 -12.11 59.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.142 -0.481 . . . . 0.0 112.095 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.2 tp -79.96 -52.15 8.2 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.387 0.613 . . . . 0.0 109.572 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.7 -15.31 62.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.72 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.49 -43.41 45.26 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.572 0.701 . . . . 0.0 109.724 171.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -61.76 -45.65 93.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.454 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.449 ' CZ3' ' HG3' ' A' ' 108' ' ' MET . 28.4 m95 -62.26 -37.43 85.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -60.49 -43.5 96.94 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.053 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' HG13 ' A' ' 24' ' ' ILE . 85.9 tttt -61.43 -50.76 71.52 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.458 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.11 -46.71 79.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.792 0.329 . . . . 0.0 111.469 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -57.44 -48.69 78.48 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.369 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 28.9 t70 -71.62 -28.88 64.09 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 -178.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 20' ' ' LYS . 50.4 mt -64.42 -42.51 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -69.98 -26.95 64.33 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.03 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.423 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 8.4 tp10 -60.44 -18.32 50.3 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.642 0.734 . . . . 0.0 109.264 169.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.14 35.26 6.38 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.84 172.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -156.48 141.84 17.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.408 ' N ' HD12 ' A' ' 29' ' ' LEU . 7.0 mp . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.492 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 109' ' ' LEU . 2.0 tm? . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 121.238 0.542 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.764 ' HB2' ' HB2' ' A' ' 134' ' ' GLU . 28.9 mtp -138.74 132.17 30.31 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 172.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.723 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 63.4 mtt -116.88 125.21 51.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.225 0.536 . . . . 0.0 112.147 -170.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.581 ' HE2' ' HA ' ' A' ' 134' ' ' GLU . 72.2 m-85 -95.17 121.63 37.01 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 168.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.511 HG21 HD13 ' A' ' 122' ' ' LEU . 40.6 t -117.02 105.59 18.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.755 0.312 . . . . 0.0 110.614 -174.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.2 m -79.37 98.42 6.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 173.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.496 HG11 HG21 ' A' ' 80' ' ' ILE . 25.2 t -79.64 -60.33 2.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.727 -172.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' A' ' 71' ' ' ASN . 39.9 t -92.62 -57.03 2.8 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.015 -173.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.735 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 82.12 11.52 82.29 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 -167.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.538 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 8.4 t30 -125.99 136.07 27.96 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 123.15 0.58 . . . . 0.0 109.709 -178.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -59.99 -16.89 41.58 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.886 3.057 . . . . 0.0 116.382 -168.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.538 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 2.7 p -69.65 172.18 7.85 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.27 0.941 . . . . 0.0 112.144 -173.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.91 -22.62 14.29 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.41 -167.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.607 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 10.8 mptt -60.65 -51.89 67.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.601 -170.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.522 ' HG2' ' H ' ' A' ' 77' ' ' THR . 1.6 pm0 -47.57 -62.58 1.37 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.979 -1.009 . . . . 0.0 111.721 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.522 ' H ' ' HG2' ' A' ' 76' ' ' GLU . 14.2 t -60.96 -43.9 98.06 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.48 0.181 . . . . 0.0 110.904 -174.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -57.4 -60.87 3.0 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.165 0.507 . . . . 0.0 110.881 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 37.6 mt-10 -67.73 -37.85 82.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.701 -172.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.496 HG21 HG11 ' A' ' 68' ' ' VAL . 9.8 tp -70.09 -39.76 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.444 -178.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.5 m -64.87 -38.03 89.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.608 177.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 24.4 p -67.47 -34.86 78.03 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.701 177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 92.5 mt -64.6 -48.85 73.38 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.965 0.412 . . . . 0.0 110.074 174.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 40.3 m0 -58.18 -39.9 80.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.803 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -57.15 -58.82 6.54 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.57 -28.07 36.15 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 115.439 -0.8 . . . . 0.0 113.804 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 32.7 m -85.15 -69.3 0.66 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 117.395 0.597 . . . . 0.0 111.805 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.5 mp -59.95 -35.09 74.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -172.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -85.67 -2.58 58.33 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -174.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -103.85 -26.27 12.75 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 171.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.85 -11.25 59.94 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.308 0.575 . . . . 0.0 109.461 168.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 66.56 78.74 0.25 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.647 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -117.13 170.65 8.5 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.667 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -125.86 98.22 5.44 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.426 HG12 ' CD2' ' A' ' 109' ' ' LEU . 30.9 m -139.02 153.7 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.756 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.446 ' HB3' ' SD ' ' A' ' 108' ' ' MET . 6.6 tp60 -101.56 145.57 28.85 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 169.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.64 ' HD3' ' N ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -148.79 132.84 17.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.618 -169.771 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -129.96 132.88 46.47 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.141 175.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.495 HD11 HG23 ' A' ' 77' ' ' THR . 8.6 tt -91.31 89.03 2.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.704 0.764 . . . . 0.0 109.677 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.4 125.62 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.056 -178.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 101.0 104.6 2.72 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 110.233 -1.147 . . . . 0.0 110.233 -167.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.446 ' O ' ' HB ' ' A' ' 77' ' ' THR . 16.0 m -47.93 -34.03 8.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.575 0.584 . . . . 0.0 112.575 -175.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.735 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 7.1 p-10 -103.22 -4.19 24.69 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -135.67 136.34 40.85 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.919 0.39 . . . . 0.0 111.789 -164.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.2 154.68 30.71 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.003 175.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.7 tt -123.41 139.05 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.412 178.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -131.41 154.32 48.77 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.114 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 18' ' ' TRP . 0.8 OUTLIER -148.38 135.32 20.07 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.357 0.599 . . . . 0.0 111.821 176.265 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.426 ' CD2' HG12 ' A' ' 95' ' ' VAL . 13.2 mt -108.93 109.33 20.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.589 174.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.72 -27.06 31.42 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 175.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -147.38 111.61 5.18 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.925 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.52 129.32 1.34 Allowed Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.756 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.3 m -95.25 -19.75 19.76 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 111.043 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -75.64 35.9 0.13 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.962 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.0 -56.44 21.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.877 -177.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.426 ' HA ' ' HB3' ' A' ' 119' ' ' LYS . 0.7 OUTLIER -73.96 -14.42 61.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.522 -176.684 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -75.55 -52.47 10.55 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.512 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.9 tt -62.38 -39.35 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.723 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 51.9 tttm -54.71 -51.67 64.86 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.511 174.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -55.49 -43.86 76.0 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.561 -178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -66.74 -39.76 88.06 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 98.7 mt -65.5 -39.97 92.5 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.046 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 30.0 m -89.41 -2.66 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 120.821 0.343 . . . . 0.0 111.081 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 37.2 t -61.99 2.16 0.24 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -87.3 104.25 16.23 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.429 0.633 . . . . 0.0 110.347 -174.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -48.31 -44.81 34.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.328 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -69.23 -44.82 71.23 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -174.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.449 ' O ' ' HB3' ' A' ' 129' ' ' ALA . 23.5 t -166.75 -152.95 0.14 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.631 -171.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 128' ' ' CYS . . . 84.25 109.23 0.06 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.048 0.939 . . . . 0.0 111.921 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -124.28 141.43 52.07 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.422 175.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 14.8 p -118.83 149.71 21.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.023 0.44 . . . . 0.0 111.474 -174.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.3 m -143.18 146.83 34.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 174.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 137' ' ' MET . 86.4 mt -86.85 162.32 17.83 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.838 0.352 . . . . 0.0 111.222 -175.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.764 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 1.6 tm-20 -67.02 130.4 43.01 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.893 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 78.97 -77.29 1.82 Allowed Glycine 0 N--CA 1.449 -0.481 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.026 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -151.46 146.38 25.88 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 122.732 0.413 . . . . 0.0 110.272 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.501 ' HA ' HD12 ' A' ' 133' ' ' LEU . 69.9 mtp -78.21 112.79 15.54 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 171.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -55.34 -48.95 95.08 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.334 -174.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.409 ' HG3' ' CZ2' ' A' ' 116' ' ' TRP . 72.6 Cg_endo -77.08 -1.72 11.91 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 121.78 1.653 . . . . 0.0 112.595 177.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 93.27 163.42 36.93 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 -174.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 117.01 0.405 . . . . 0.0 110.186 178.693 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 112.431 -0.267 . . . . 0.0 112.431 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 58.8 23.38 11.17 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.258 0.551 . . . . 0.0 110.619 -177.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 50.6 mm -65.38 -43.46 94.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.632 -178.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 37.3 mtm105 -61.15 -50.16 74.3 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.506 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.98 -49.76 74.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.336 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -58.78 -46.92 86.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.15 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.419 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 3.2 m-80 -53.19 -71.56 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.173 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -53.6 -61.86 2.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.197 -176.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.405 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.4 -63.34 1.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.663 -172.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.58 -43.53 89.46 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.795 -170.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.419 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 35.3 mtp -72.88 -32.5 65.43 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 120.516 -0.474 . . . . 0.0 111.055 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.32 88.99 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 172.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 94.7 mtt180 -69.23 -18.85 63.93 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.881 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 66.2 tp -79.52 -52.84 7.51 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.008 0.432 . . . . 0.0 110.168 175.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 15' ' ' LEU . 3.9 mm? -71.95 -9.37 58.26 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.781 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -48.25 -40.48 24.76 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.64 0.733 . . . . 0.0 109.159 168.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 51.2 tp60 -61.49 -50.06 74.25 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.442 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.433 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 13.8 m95 -59.73 -35.13 73.93 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.485 -177.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -60.95 -46.19 91.71 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -59.08 -44.17 91.88 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.976 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -59.32 -55.09 39.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.718 0.294 . . . . 0.0 110.632 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.2 -37.72 78.13 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.92 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.08 -50.43 73.3 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.59 176.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.513 HG12 HD13 ' A' ' 29' ' ' LEU . 77.2 mt -58.57 -39.46 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-O 121.134 0.493 . . . . 0.0 110.248 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.7 -35.15 79.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -78.41 -1.21 32.43 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.717 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.13 27.46 37.02 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.38 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -126.75 109.94 12.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.617 0.246 . . . . 0.0 110.392 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.513 HD13 HG12 ' A' ' 24' ' ' ILE . 3.5 mm? . . . . . 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 175.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 6.7 tt . . . . . 0 C--O 1.238 0.474 0 CA-C-O 121.841 0.829 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.424 ' HG2' ' HA ' ' A' ' 108' ' ' MET . 67.4 mtp -141.02 144.33 34.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.631 172.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.2 mtt -118.42 122.43 42.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.86 0.362 . . . . 0.0 111.385 -176.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.522 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 52.2 m-85 -98.47 95.38 7.28 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 171.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.9 t -87.83 146.43 6.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 O-C-N 122.244 -0.285 . . . . 0.0 110.327 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.476 ' HB ' ' NH2' ' A' ' 104' ' ' ARG . 7.2 t -125.26 110.37 13.96 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 174.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.527 HG11 HG21 ' A' ' 80' ' ' ILE . 21.4 t -98.44 -60.94 2.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.355 -169.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -83.34 -50.08 8.72 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.862 -170.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 68.8 20.34 74.2 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -168.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -126.35 136.97 29.36 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 114.743 -0.729 . . . . 0.0 109.125 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -64.05 -15.79 51.26 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.32 2.68 . . . . 0.0 114.693 -172.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.615 HG22 ' HD3' ' A' ' 75' ' ' LYS . 17.1 m -75.76 119.97 20.5 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.555 0.693 . . . . 0.0 111.26 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -55.58 -23.62 28.18 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.528 0.731 . . . . 0.0 111.557 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.615 ' HD3' HG22 ' A' ' 73' ' ' THR . 11.0 mptt -62.2 -62.83 1.49 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.705 -169.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.452 ' OE1' ' HB ' ' A' ' 73' ' ' THR . 13.8 pm0 -65.95 -37.15 85.27 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.543 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.509 HG23 HD11 ' A' ' 99' ' ' ILE . 12.2 t -68.3 -38.79 82.0 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.638 0.256 . . . . 0.0 110.312 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.83 -46.62 89.84 Favored 'General case' 0 C--O 1.232 0.138 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 45.7 mt-10 -56.18 -54.24 47.54 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.134 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.608 HD12 HD12 ' A' ' 83' ' ' LEU . 11.1 tp -63.19 -43.14 98.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 CA-C-O 120.946 0.403 . . . . 0.0 111.006 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.8 m -66.69 -30.7 71.02 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.065 0.46 . . . . 0.0 110.21 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.7 t -70.68 -33.9 71.4 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.699 177.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.608 HD12 HD12 ' A' ' 80' ' ' ILE . 88.0 mt -63.52 -45.16 91.91 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.254 0.549 . . . . 0.0 109.705 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.684 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.1 m0 -60.85 -44.66 96.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.948 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -57.84 -38.64 76.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.234 0.54 . . . . 0.0 109.982 172.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.18 -31.35 77.28 Favored Glycine 0 CA--C 1.521 0.413 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.737 -178.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.4 m -95.99 -60.36 1.65 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.77 -48.05 80.77 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 -172.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.402 ' CZ ' ' HD2' ' A' ' 97' ' ' ARG . 64.7 m-85 -69.95 -32.7 71.08 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.739 0.304 . . . . 0.0 110.892 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -67.66 -28.22 67.52 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.237 0.541 . . . . 0.0 109.705 175.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.85 8.73 11.6 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.366 175.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 68.13 30.17 5.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.094 174.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -89.45 108.36 19.6 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 173.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -80.47 62.74 4.68 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.328 0.585 . . . . 0.0 110.623 178.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.5 m -90.45 167.75 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.113 176.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.749 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.8 tp60 -110.17 143.13 40.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.447 173.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.461 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.86 135.13 35.89 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.726 0.298 . . . . 0.0 110.539 -177.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -131.02 153.45 49.24 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.509 HD11 HG23 ' A' ' 77' ' ' THR . 9.4 tt -130.71 90.04 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.68 0.752 . . . . 0.0 110.745 -179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.2 p -130.57 128.24 63.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 100.9 104.01 2.67 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.209 -1.156 . . . . 0.0 110.209 -167.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -46.68 -25.63 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.449 ' O ' ' HA ' ' A' ' 67' ' ' THR . 12.1 p-10 -100.67 -27.73 13.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.319 0.58 . . . . 0.0 110.209 178.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.476 ' NH2' ' HB ' ' A' ' 67' ' ' THR . 0.2 OUTLIER -84.62 121.57 27.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.434 -1.257 . . . . 0.0 112.764 -171.322 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -116.42 132.42 56.68 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 13.0 tt -124.38 132.25 71.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-O 121.083 0.468 . . . . 0.0 111.44 -173.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -120.74 128.75 53.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.355 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.749 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 1.8 mpt? -99.16 122.33 42.22 Favored 'General case' 0 C--O 1.247 0.971 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.347 177.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.454 ' N ' HD22 ' A' ' 109' ' ' LEU . 2.4 mm? -117.64 121.66 41.48 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 123.839 0.712 . . . . 0.0 109.264 174.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.7 mmm-85 -67.89 -49.11 63.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -128.27 110.99 12.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.769 172.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -89.86 47.01 3.15 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.616 -175.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.2 m -59.56 -39.69 84.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.269 0.557 . . . . 0.0 110.481 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 22.0 p90 -98.34 23.32 8.53 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.154 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.46 -41.54 97.39 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.509 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 5.9 m95 -67.71 -34.05 76.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.353 -176.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -59.55 -43.58 93.5 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.102 0.477 . . . . 0.0 109.91 175.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.559 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -65.39 -42.22 93.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.23 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.481 176.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -53.72 -52.06 61.32 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.225 0.536 . . . . 0.0 110.182 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.447 ' HA ' HG22 ' A' ' 123' ' ' VAL . 1.7 m-20 -62.04 -38.1 87.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.635 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -61.86 -53.68 52.55 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.722 0.296 . . . . 0.0 110.464 177.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 76.0 mt -50.65 -47.69 58.49 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.419 177.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.447 HG22 ' HA ' ' A' ' 120' ' ' ASP . 19.8 m -80.22 -13.34 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.583 0.23 . . . . 0.0 111.412 -177.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.1 t -73.9 -0.78 17.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.957 0.408 . . . . 0.0 110.558 175.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.684 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 21.3 mt-30 -84.13 165.24 18.63 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.079 0.466 . . . . 0.0 110.955 -178.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -78.79 -47.1 17.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.776 -167.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -86.89 -20.68 27.06 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.094 177.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 57.6 m 67.37 175.36 0.26 Allowed 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.433 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -161.24 156.46 24.18 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.96 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -99.74 157.1 16.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.246 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 12.0 p -131.69 151.66 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.139 0.495 . . . . 0.0 111.221 -174.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.522 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 59.8 m -124.87 134.49 52.68 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.646 HD12 ' SD ' ' A' ' 137' ' ' MET . 88.9 mt -96.5 142.75 28.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.329 -175.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -84.09 132.67 34.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.963 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.59 -86.94 1.14 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.174 -0.467 . . . . 0.0 112.219 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -141.43 151.47 43.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.684 0.278 . . . . 0.0 110.422 -176.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.646 ' SD ' HD12 ' A' ' 133' ' ' LEU . 15.1 tpt -72.41 94.67 1.67 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 175.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.504 ' CD2' HD13 ' A' ' 133' ' ' LEU . 11.4 m-85 -53.65 -50.87 81.02 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.29 -175.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 5.8 Cg_exo -81.51 31.92 0.52 Allowed 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 122.809 2.34 . . . . 0.0 112.549 179.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -163.15 68.79 0.22 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.005 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 95.5 mttt . . . . . 0 C--O 1.238 0.499 0 CA-C-O 120.882 0.372 . . . . 0.0 111.058 -177.587 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.875 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 t70 69.03 116.33 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.176 0.59 . . . . 0.0 112.427 177.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.2 tt -130.47 13.04 2.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-O 122.246 1.022 . . . . 0.0 108.408 171.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 18.4 ttp180 -63.06 -37.28 86.57 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.382 -1.281 . . . . 0.0 111.651 -175.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 1.1 m-20 -58.19 -46.62 85.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.19 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.554 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.9 OUTLIER -54.32 -47.67 72.23 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 173.342 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.512 ' O ' ' HB2' ' A' ' 11' ' ' MET . 0.8 OUTLIER -50.63 -76.18 0.02 OUTLIER 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.735 -177.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -61.3 -61.94 2.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.14 -176.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 5' ' ' ASP . . . -62.44 -50.64 70.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.949 -169.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.554 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 1.3 m-20 -78.48 -43.57 26.74 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.523 -172.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.528 ' O ' HD23 ' A' ' 15' ' ' LEU . 8.9 mmt -63.12 -43.05 99.49 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.833 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 16' ' ' GLU . . . -64.51 -53.91 40.72 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.902 0.382 . . . . 0.0 110.327 177.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.1 ttp-105 -52.33 -38.75 59.42 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.946 -175.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.6 tp -84.88 -49.16 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.334 -177.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 11' ' ' MET . 4.5 mm? -68.11 -21.43 64.95 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -172.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 12' ' ' ALA . 29.8 mt-10 -55.64 -25.71 40.58 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.914 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 46.4 tt0 -63.08 -49.74 73.31 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 176.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -64.31 -35.29 80.36 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.161 -177.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.98 -53.19 61.01 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 171.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.517 ' O ' HG13 ' A' ' 24' ' ' ILE . 20.1 ttpp -51.67 -43.11 62.59 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.791 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -62.21 -52.79 62.36 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.546 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -69.55 -28.24 65.83 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.4 -177.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -65.16 -45.78 83.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.1 0.476 . . . . 0.0 110.397 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 20' ' ' LYS . 68.6 mt -60.75 -43.91 96.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.341 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -66.14 -36.25 82.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.492 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -63.75 -26.25 68.56 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.413 0.625 . . . . 0.0 109.763 175.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.97 40.84 4.5 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.518 176.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -147.04 110.3 4.82 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 173.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.236 0.363 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.527 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.402 HD22 HD23 ' A' ' 133' ' ' LEU . 2.5 pp . . . . . 0 C--O 1.243 0.753 0 CA-C-O 122.402 1.096 . . . . 0.0 113.553 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 23.8 ptp -125.69 132.61 52.36 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 113.709 -1.587 . . . . 0.0 107.99 174.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.457 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 82.8 mtp -108.29 116.91 32.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 -174.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.441 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 56.5 m-85 -89.16 125.51 35.08 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.525 HG11 HD22 ' A' ' 122' ' ' LEU . 22.1 t -115.83 98.3 6.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -175.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.756 ' HB ' ' HB3' ' A' ' 130' ' ' GLU . 4.9 m -74.41 94.92 2.63 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 176.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 p -102.11 -47.1 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.096 -169.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.0 m -91.26 -49.23 6.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.883 0.373 . . . . 0.0 111.569 -172.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 66.99 10.96 57.56 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -170.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 33.2 t30 -127.2 125.72 24.11 Favored Pre-proline 0 CA--C 1.533 0.306 0 C-N-CA 123.229 0.612 . . . . 0.0 109.565 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 25.4 Cg_exo -61.94 -18.3 60.48 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.282 2.655 . . . . 0.0 113.503 -177.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.445 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 37.7 m -55.44 104.15 0.12 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.699 0.4 . . . . 0.0 111.073 177.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.498 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 42.1 mt-10 -50.05 -25.93 3.88 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -177.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.579 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 0.3 OUTLIER -58.49 -37.61 75.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.809 -177.113 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -57.74 -64.79 0.78 Allowed 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.639 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.464 ' HA ' HG22 ' A' ' 80' ' ' ILE . 12.6 t -62.3 -36.13 81.17 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.648 -177.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -53.47 -59.7 4.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.988 0.423 . . . . 0.0 110.922 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.78 -45.74 74.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.373 -175.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.464 HG22 ' HA ' ' A' ' 77' ' ' THR . 10.8 tp -66.92 -42.02 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.164 -175.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 67.8 m -69.86 -33.15 71.87 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.638 0.256 . . . . 0.0 110.447 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.6 t -59.33 -47.53 85.04 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.114 0.483 . . . . 0.0 109.719 175.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.8 mt -59.78 -48.19 82.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.053 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.582 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 44.1 m0 -58.69 -32.74 69.42 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.032 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.626 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 29.6 tt0 -66.1 -62.77 1.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 90' ' ' ASN . . . -57.69 -18.12 30.19 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.791 -0.64 . . . . 0.0 114.143 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.3 m -95.88 -65.28 0.98 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 117.498 0.649 . . . . 0.0 111.574 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.0 mp -65.33 -52.31 54.76 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.83 0.348 . . . . 0.0 111.34 -173.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.626 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 98.1 m-85 -72.27 -9.13 58.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 0.0 111.156 -176.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 86' ' ' GLY . 39.2 t30 -72.81 -26.81 61.64 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.51 14.32 17.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.759 177.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 60.11 77.35 0.32 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.037 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -107.33 119.14 38.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.548 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -78.09 69.35 4.29 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.691 0.757 . . . . 0.0 109.768 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.533 HG22 HD13 ' A' ' 109' ' ' LEU . 57.7 t -126.02 136.79 59.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.586 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -101.6 115.46 30.57 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.597 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -107.49 131.93 53.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.243 -175.21 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.529 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.5 m-30 -110.55 131.09 55.35 Favored 'General case' 0 C--O 1.247 0.962 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.4 tt -111.38 89.69 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.991 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -149.44 144.39 17.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 70.68 82.51 0.23 Allowed Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 109.966 -1.254 . . . . 0.0 109.966 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.498 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 12.6 m -50.13 -23.6 2.25 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -168.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -61.0 -25.07 66.62 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.678 0.275 . . . . 0.0 110.828 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -145.49 159.62 42.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.612 0.72 . . . . 0.0 112.398 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -122.64 139.54 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.857 -1.065 . . . . 0.0 108.326 168.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.529 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 5.1 tt -110.12 126.3 67.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.588 -177.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.464 ' HB3' HG11 ' A' ' 95' ' ' VAL . 96.8 m-85 -112.25 112.1 23.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.185 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.506 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 68.5 mtm -90.93 122.43 33.61 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 176.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.533 HD13 HG22 ' A' ' 95' ' ' VAL . 4.0 mm? -87.61 103.92 16.02 Favored 'General case' 0 C--O 1.232 0.148 0 O-C-N 123.513 0.508 . . . . 0.0 110.718 -175.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.6 -28.95 56.34 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 172.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -135.2 116.27 14.27 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 114.677 -1.147 . . . . 0.0 108.644 172.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -103.92 16.52 50.56 Favored Glycine 0 CA--C 1.52 0.387 0 C-N-CA 121.223 -0.513 . . . . 0.0 114.038 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -60.5 -20.39 59.98 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 117.207 0.504 . . . . 0.0 111.373 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -120.0 24.73 10.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.071 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.48 -37.87 87.65 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.435 -177.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -79.92 -27.01 39.92 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.02 -178.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -63.15 -50.47 70.3 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 175.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.611 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.0 tt -64.68 -41.47 92.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.129 176.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.448 ' HG3' HG11 ' A' ' 131' ' ' VAL . 86.7 tttt -54.83 -53.01 60.78 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.816 0.341 . . . . 0.0 110.943 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.493 ' HA ' HG22 ' A' ' 123' ' ' VAL . 20.0 m-20 -61.08 -39.14 88.79 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.584 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.433 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 89.7 t80 -60.31 -39.96 88.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.924 0.392 . . . . 0.0 109.988 177.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.2 mt -66.55 -41.01 89.33 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.375 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' A' ' 120' ' ' ASP . 18.7 m -75.61 -19.08 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.728 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 54.1 m -82.33 0.05 43.46 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.329 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.582 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 15.1 mm100 -73.77 162.87 28.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.897 0.38 . . . . 0.0 111.036 -177.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -54.31 -64.4 0.84 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.373 -174.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 127' ' ' ARG . 40.7 mtt180 -65.2 -7.6 13.54 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 44.0 t 57.25 79.24 0.2 Allowed 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -172.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.41 140.77 57.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 -171.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.756 ' HB3' ' HB ' ' A' ' 67' ' ' THR . 39.8 tt0 -79.12 118.39 21.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.727 177.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.448 HG11 ' HG3' ' A' ' 119' ' ' LYS . 48.1 t -101.55 130.14 51.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.47 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 20.7 p -135.86 129.33 32.18 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.457 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.1 mp -112.43 127.23 55.97 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -177.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -120.71 150.31 41.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.972 177.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 129.17 -96.79 0.4 Allowed Glycine 0 N--CA 1.453 -0.192 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -125.51 104.85 8.64 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 174.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.499 ' HE2' ' HD2' ' A' ' 139' ' ' PRO . 0.1 OUTLIER -81.19 84.32 6.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.996 0.427 . . . . 0.0 110.077 -179.01 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.476 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 40.6 p90 -76.22 -32.78 1.15 Allowed Pre-proline 0 CA--C 1.545 0.776 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.499 ' HD2' ' HE2' ' A' ' 137' ' ' MET . 5.6 Cg_exo -77.93 119.44 4.72 Favored 'Trans proline' 0 C--N 1.365 1.402 0 C-N-CA 121.8 1.667 . . . . 0.0 112.115 -178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 69.01 -119.8 10.0 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.344 -0.455 . . . . 0.0 112.495 178.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 97.2 mttt . . . . . 0 C--O 1.237 0.404 0 C-N-CA 122.393 0.277 . . . . 0.0 110.632 -178.189 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.997 0 N-CA-C 111.921 -0.472 . . . . 0.0 111.921 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -91.57 39.04 0.99 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -172.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.429 HG23 ' ND2' ' A' ' 7' ' ' ASN . 15.3 tt -77.43 52.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-O 122.268 1.032 . . . . 0.0 108.592 172.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 92.2 mtt-85 -71.62 -42.1 68.05 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -163.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -51.74 -50.13 61.2 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.886 0.374 . . . . 0.0 110.981 -172.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.485 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -63.29 -41.32 98.96 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.95 179.19 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.645 ' HA ' ' HG3' ' A' ' 11' ' ' MET . 14.4 m-80 -55.7 -72.14 0.08 Allowed 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.05 -63.06 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.344 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.13 -66.29 0.56 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.648 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -69.5 -43.85 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.928 -169.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.645 ' HG3' ' HA ' ' A' ' 7' ' ' ASN . 1.3 mmt -70.68 -45.27 65.35 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.778 -176.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.25 97.49 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.511 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -81.24 -12.84 59.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.531 -177.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.525 ' HG ' HD22 ' A' ' 15' ' ' LEU . 5.5 tp -82.17 -54.33 5.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.026 0.441 . . . . 0.0 110.089 169.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.532 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 4.4 mm? -65.59 -25.55 67.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.92 -177.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -51.78 -42.18 62.21 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.325 0.584 . . . . 0.0 109.967 176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -61.55 -48.82 79.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.273 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.506 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 43.6 m95 -58.32 -40.05 81.02 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.877 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 15' ' ' LEU . 41.7 mm-40 -61.36 -49.56 76.46 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.787 178.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.482 ' O ' HG13 ' A' ' 24' ' ' ILE . 78.9 tttt -60.61 -38.45 84.73 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.937 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -43.1 98.26 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.817 0.341 . . . . 0.0 110.673 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -63.06 -39.82 95.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.303 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -61.43 -45.43 94.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.863 0.364 . . . . 0.0 110.496 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.4 mt -61.35 -36.4 72.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.442 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.1 -45.01 74.92 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -66.9 -17.91 65.13 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.988 176.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.84 48.83 3.29 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.441 173.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -150.29 128.92 12.3 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.422 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.532 0.272 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.157 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.431 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.157 0.503 . . . . 0.0 110.467 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.668 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 15.6 ptm -144.47 112.4 6.3 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.928 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.526 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 65.7 mtt -114.22 122.82 47.93 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.412 -175.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -93.93 111.14 22.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 171.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.425 HG22 HG13 ' A' ' 131' ' ' VAL . 30.0 t -112.14 112.29 39.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 122.241 -0.287 . . . . 0.0 110.96 -172.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.62 HG23 ' HB2' ' A' ' 130' ' ' GLU . 3.8 t -87.56 107.07 18.42 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.3 m -101.79 -40.04 7.08 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.037 -171.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.465 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 36.7 t -86.9 -55.54 3.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.482 -172.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.704 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 78.38 -4.92 57.78 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.92 -0.657 . . . . 0.0 111.525 -171.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -125.87 132.78 24.42 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 123.323 0.649 . . . . 0.0 109.416 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.638 ' O ' ' HB3' ' A' ' 102' ' ' SER . 35.1 Cg_endo -60.13 -16.37 39.45 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.375 2.717 . . . . 0.0 114.389 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.429 ' CG2' ' HD3' ' A' ' 75' ' ' LYS . 23.7 m -60.96 100.17 0.11 Allowed 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.933 -0.48 . . . . 0.0 110.116 173.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 1.3 mp0 -57.11 -23.21 45.43 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.404 -174.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.556 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -55.46 -34.73 64.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.361 -173.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.413 ' O ' HD13 ' A' ' 80' ' ' ILE . 34.9 mm-40 -59.26 -50.9 72.24 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.314 0.578 . . . . 0.0 109.484 176.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.8 m -67.83 -29.73 68.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.815 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.36 -49.86 72.2 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 176.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -59.76 -48.37 81.96 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 110.059 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.442 HG13 ' NE2' ' A' ' 125' ' ' GLN . 1.5 mp -53.72 -54.06 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.062 178.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 87.0 m -62.82 -35.45 79.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.076 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.6 t -63.7 -57.34 10.3 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 120.925 0.393 . . . . 0.0 110.635 -179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.86 -44.23 97.24 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.811 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.53 ' CZ3' HD22 ' A' ' 122' ' ' LEU . 45.3 m0 -63.89 -38.73 92.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.532 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -59.91 -60.98 2.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -47.17 -52.17 13.25 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.968 177.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.1 m -59.3 -54.78 42.86 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.777 0.323 . . . . 0.0 111.686 -176.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 84' ' ' TRP . 9.7 mp -69.28 -29.15 66.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.405 -175.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -75.66 -30.61 59.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.6 178.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.35 -30.99 70.94 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.967 0.413 . . . . 0.0 110.307 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.71 4.57 36.07 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.384 175.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.8 t30 60.91 66.19 0.93 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.146 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -115.57 101.29 8.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.57 173.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -73.74 73.66 1.54 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.501 0.667 . . . . 0.0 110.621 177.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 7.2 m -87.98 157.21 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.528 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.506 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.9 tp60 -110.94 100.93 9.55 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.671 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.3 OUTLIER -109.8 138.81 45.64 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.768 -1.106 . . . . 0.0 109.575 -174.008 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.416 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 68.3 m-85 -134.98 128.52 32.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.26 176.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.5 tt -87.87 87.57 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-O 121.926 0.87 . . . . 0.0 108.918 169.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 2.7 p -132.35 121.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 176.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.485 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 100.8 102.74 2.56 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 -163.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.638 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 41.0 m -37.67 -50.6 1.19 Allowed 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -171.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.704 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.5 p-10 -100.62 7.44 43.98 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -173.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 78.5 mtt180 -128.5 139.59 52.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.227 0.537 . . . . 0.0 111.809 -173.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -117.08 128.16 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.05 171.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.416 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 9.8 tt -98.31 123.14 50.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 CA-C-O 121.173 0.511 . . . . 0.0 110.641 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -112.59 108.13 17.1 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.848 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.464 ' SD ' HD11 ' A' ' 15' ' ' LEU . 70.5 mtm -108.34 130.67 55.19 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.093 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 65.8 mt -117.88 122.5 43.5 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.119 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.452 HH11 ' HG3' ' A' ' 110' ' ' ARG . 0.0 OUTLIER -68.49 -49.86 56.56 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.021 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -113.12 111.67 22.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.977 -1.011 . . . . 0.0 108.706 172.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -108.54 43.86 1.62 Allowed Glycine 0 C--N 1.332 0.308 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.817 -171.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.4 m -61.55 -31.6 71.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 110.586 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -101.99 21.31 14.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.014 -176.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.92 -54.94 40.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.581 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -31.56 71.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.984 -174.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -66.02 -39.55 90.32 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.078 0.466 . . . . 0.0 109.755 177.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.571 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.2 mt -60.76 -52.77 57.68 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.229 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.195 173.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -50.22 -48.39 54.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.94 0.4 . . . . 0.0 110.388 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -59.83 -42.82 94.39 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.995 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.57 -50.16 68.37 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.057 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 13.4 mt -57.68 -43.31 84.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.135 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -74.7 -26.9 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 120.995 -0.282 . . . . 0.0 111.572 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -78.62 2.66 18.63 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.255 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.443 ' HG3' ' HE1' ' A' ' 84' ' ' TRP . 1.1 tm0? -74.13 161.27 30.17 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.776 0.322 . . . . 0.0 111.024 -171.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -66.74 -66.24 0.58 Allowed 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.696 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.424 ' N ' ' OE1' ' A' ' 125' ' ' GLN . 36.1 mtm180 -69.99 -3.02 14.33 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.282 176.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.507 ' SG ' ' N ' ' A' ' 129' ' ' ALA . 42.1 t 73.77 176.58 0.25 Allowed 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.212 0.605 . . . . 0.0 111.48 174.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.507 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -169.8 135.24 1.43 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.711 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.62 ' HB2' HG23 ' A' ' 67' ' ' THR . 39.2 mm-40 -102.23 113.64 27.1 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 173.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.425 HG13 HG22 ' A' ' 66' ' ' VAL . 46.1 t -94.16 120.13 43.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 -177.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.6 m -107.79 130.06 55.0 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.526 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 4.9 mp -106.37 114.54 28.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.668 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 27.0 mm-40 -76.13 150.18 37.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 -178.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 104.47 -100.82 1.86 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.001 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -133.84 146.66 50.82 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.725 0.298 . . . . 0.0 110.554 -178.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.43 ' CE ' ' HA ' ' A' ' 137' ' ' MET . 10.2 mmt -78.24 100.55 6.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.936 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.431 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 21.5 m-85 -55.42 -53.09 66.0 Favored Pre-proline 0 CA--C 1.541 0.626 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.462 -177.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 57.9 Cg_endo -70.01 107.27 1.87 Allowed 'Trans proline' 0 C--N 1.359 1.118 0 C-N-CA 121.859 1.706 . . . . 0.0 111.953 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 113.61 -22.42 15.0 Favored Glycine 0 N--CA 1.454 -0.149 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.989 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 66.5 mttm . . . . . 0 C--O 1.235 0.322 0 C-N-CA 122.357 0.263 . . . . 0.0 110.47 -179.599 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.748 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -79.02 76.76 5.51 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.03 0.443 . . . . 0.0 110.138 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.8 tt -81.24 64.63 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 122.122 0.963 . . . . 0.0 110.335 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.549 ' HA ' ' HB2' ' A' ' 7' ' ' ASN . 12.1 mtp180 -70.69 -17.54 62.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.732 -176.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.403 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 13.2 t70 -54.55 -52.34 62.36 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 178.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.513 ' OH ' ' HB3' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -66.27 -44.51 83.38 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.17 178.667 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.549 ' HB2' ' HA ' ' A' ' 4' ' ' ARG . 25.3 m-80 -51.3 -78.58 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.239 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -51.96 -59.88 3.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.788 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.583 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -67.86 -60.6 2.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -171.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.616 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 12.8 t70 -69.66 -39.13 77.25 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.974 -169.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.518 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 2.0 mmt -64.42 -45.5 87.31 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.65 -42.58 71.47 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.871 0.367 . . . . 0.0 110.218 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.616 ' HD2' ' HA ' ' A' ' 10' ' ' ASP . 81.9 mtt180 -54.09 -62.38 1.69 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.083 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.499 HD12 HD22 ' A' ' 15' ' ' LEU . 3.9 pp -80.33 -18.41 49.24 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -171.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.499 HD22 HD12 ' A' ' 14' ' ' LEU . 3.5 mm? -79.34 -30.49 42.73 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.132 -0.355 . . . . 0.0 110.945 175.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -50.09 -39.02 41.33 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.265 0.555 . . . . 0.0 110.513 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -61.28 -38.93 88.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.238 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.503 ' CZ2' ' HG2' ' A' ' 108' ' ' MET . 61.7 m95 -66.15 -42.48 88.98 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.211 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -62.59 -46.68 87.2 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.557 ' O ' HG13 ' A' ' 24' ' ' ILE . 22.9 tttm -51.58 -54.33 28.81 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.729 177.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.8 -38.88 76.79 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -173.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -60.0 -45.63 92.13 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.396 0.617 . . . . 0.0 109.377 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 36.9 m-20 -66.54 -28.56 68.64 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.4 178.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.557 HG13 ' O ' ' A' ' 20' ' ' LYS . 60.1 mt -70.83 -42.85 77.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 120.814 0.34 . . . . 0.0 110.255 176.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -73.32 -16.97 61.35 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.047 0.451 . . . . 0.0 109.972 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.454 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.5 tp10 -58.89 -15.15 11.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.443 0.64 . . . . 0.0 109.639 168.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.45 28.14 11.99 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.192 -0.913 . . . . 0.0 113.238 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -160.51 158.88 30.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.1 mm? . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.941 -175.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 62.9 mt . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.588 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 21.8 ptp -138.53 114.34 9.93 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.772 171.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 86.0 mtp -108.88 117.81 35.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.535 -173.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.528 ' HB2' ' HB ' ' A' ' 132' ' ' THR . 1.3 m-85 -97.42 121.31 39.17 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.0 t -117.11 105.51 18.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.787 0.327 . . . . 0.0 110.492 -175.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 10.1 m -78.29 105.84 9.8 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.765 HG11 HG21 ' A' ' 80' ' ' ILE . 41.3 t -88.97 -61.77 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.482 -170.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.515 ' HB2' ' HG3' ' A' ' 76' ' ' GLU . 47.4 t -92.59 -46.46 7.6 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.332 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 78.96 2.97 87.74 Favored Glycine 0 CA--C 1.519 0.287 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -168.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.543 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 9.3 t30 -121.81 132.0 24.32 Favored Pre-proline 0 CA--C 1.532 0.278 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 102' ' ' SER . 46.5 Cg_endo -63.43 -15.46 48.58 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.59 2.86 . . . . 0.0 116.058 -165.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.543 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 0.9 OUTLIER -71.7 133.01 45.35 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.184 0.902 . . . . 0.0 112.437 -169.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -50.33 -42.14 52.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 114.386 -1.279 . . . . 0.0 113.589 -178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.882 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 3.0 mptp? -49.15 -60.84 2.45 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -165.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.515 ' HG3' ' HB2' ' A' ' 69' ' ' SER . 2.1 pm0 -50.81 -60.39 3.11 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.795 -0.638 . . . . 0.0 112.053 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.679 ' HA ' HG22 ' A' ' 80' ' ' ILE . 45.5 m -71.08 -28.36 64.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.841 -174.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.38 -52.24 66.45 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.464 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 43.6 mt-10 -64.97 -48.0 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.243 -178.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.765 HG21 HG11 ' A' ' 68' ' ' VAL . 10.6 tp -62.31 -41.96 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.74 -177.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 96.5 m -67.26 -32.95 74.32 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.862 0.363 . . . . 0.0 110.433 178.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.2 t -62.47 -40.31 96.22 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 174.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.648 HD12 HD12 ' A' ' 80' ' ' ILE . 77.0 mt -62.58 -44.75 95.53 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.854 175.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.527 ' HZ2' HE22 ' A' ' 125' ' ' GLN . 49.0 m0 -57.25 -37.36 72.2 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.601 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.455 ' HA ' ' HD2' ' A' ' 89' ' ' PHE . 0.9 OUTLIER -62.3 -61.49 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.732 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -58.51 -19.84 43.03 Favored Glycine 0 CA--C 1.523 0.542 0 CA-C-N 115.683 -0.689 . . . . 0.0 114.266 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.534 ' HB2' HD12 ' A' ' 88' ' ' LEU . 18.1 m -96.38 -69.33 0.76 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.081 0.44 . . . . 0.0 111.193 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.534 HD12 ' HB2' ' A' ' 87' ' ' SER . 4.7 mp -78.51 -57.46 3.76 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 120.952 0.406 . . . . 0.0 111.259 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.455 ' HD2' ' HA ' ' A' ' 85' ' ' GLN . 94.9 m-85 -68.85 -11.34 60.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.251 -173.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -71.98 -27.04 62.5 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.771 175.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.96 3.67 22.14 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.038 174.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 62.99 66.33 0.75 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.625 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -84.46 160.71 20.5 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.154 172.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -95.37 15.88 18.32 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.094 0.473 . . . . 0.0 110.93 -177.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.3 t -88.17 151.55 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.96 176.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -132.39 140.86 48.65 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.05 159.03 42.03 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.482 -0.192 . . . . 0.0 110.482 -173.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -138.53 154.84 48.78 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.695 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.3 tt -115.5 89.82 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.011 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -118.42 132.73 67.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 173.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 61.3 82.89 0.07 OUTLIER Glycine 0 C--N 1.332 0.34 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 -166.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.42 ' HB2' ' O ' ' A' ' 72' ' ' PRO . 16.9 m -43.69 -42.15 5.17 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -166.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -52.46 -21.7 3.98 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.513 ' HB3' ' OH ' ' A' ' 6' ' ' TYR . 33.0 ttt180 -133.12 133.2 42.61 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.899 0.38 . . . . 0.0 110.741 -175.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.88 134.39 52.13 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.2 tt -108.55 132.74 55.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.72 -176.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -106.09 123.78 48.55 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.425 176.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.503 ' HG2' ' CZ2' ' A' ' 18' ' ' TRP . 2.1 mpt? -96.11 114.0 25.66 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 171.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.461 ' N ' HD22 ' A' ' 109' ' ' LEU . 2.2 mm? -101.34 103.81 14.78 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.471 -178.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 26.8 mmm-85 -76.24 -50.34 14.71 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 166.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -104.37 110.65 22.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.989 -1.005 . . . . 0.0 108.518 172.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -110.68 11.76 30.15 Favored Glycine 0 C--N 1.33 0.206 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.358 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.1 t -58.54 -40.19 82.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.103 0.478 . . . . 0.0 110.423 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -97.85 21.35 10.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.536 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.33 -37.65 88.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.057 0.456 . . . . 0.0 110.404 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -70.76 -22.76 62.36 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.646 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -73.08 -37.42 66.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.449 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 mt -63.09 -47.82 90.74 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.26 173.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -57.46 -41.84 81.36 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -58.31 -44.93 88.83 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.343 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . 0.412 ' HE2' ' CD1' ' A' ' 84' ' ' TRP . 73.1 t80 -64.02 -50.35 68.84 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.249 177.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 96.4 mt -49.64 -43.91 47.16 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.941 177.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.655 ' HA ' ' SG ' ' A' ' 128' ' ' CYS . 28.7 m -84.83 -14.35 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-O 120.971 0.415 . . . . 0.0 111.033 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -80.27 1.1 29.91 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.121 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.527 HE22 ' HZ2' ' A' ' 84' ' ' TRP . 40.9 mt-30 -71.84 165.09 24.83 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.965 179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -54.21 -64.99 0.65 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.635 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -101.05 -15.46 17.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.052 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.655 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 48.8 t 70.88 170.11 0.32 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.068 0.547 . . . . 0.0 111.154 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.453 ' N ' ' SG ' ' A' ' 128' ' ' CYS . . . -135.91 171.19 14.82 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.734 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.567 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 44.3 mt-10 -84.34 115.04 22.29 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.597 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.5 t -87.83 132.9 31.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.332 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.528 ' HB ' ' HB2' ' A' ' 65' ' ' PHE . 9.2 m -131.51 138.17 48.84 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.704 ' HB2' ' HG2' ' A' ' 137' ' ' MET . 35.1 mt -122.2 111.91 17.53 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -178.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.588 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 28.3 mm-40 -93.14 136.25 33.58 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.4 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.66 -60.08 0.44 Allowed Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 111.605 -0.598 . . . . 0.0 111.605 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -170.41 133.98 1.11 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.704 ' HG2' ' HB2' ' A' ' 133' ' ' LEU . 72.7 mtp -105.75 114.44 28.6 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.528 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 86.6 m-85 -61.29 -52.69 69.12 Favored Pre-proline 0 CA--C 1.541 0.626 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.1 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 19.8 Cg_endo -57.68 121.48 10.11 Favored 'Trans proline' 0 C--N 1.361 1.2 0 C-N-CA 122.217 1.945 . . . . 0.0 112.308 -175.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 99.03 -21.37 46.22 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.33 -0.462 . . . . 0.0 112.28 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 C--N 1.33 -0.278 0 CA-C-O 120.818 0.342 . . . . 0.0 110.575 -179.767 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.893 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -92.93 162.86 13.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.527 0.204 . . . . 0.0 111.106 179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.697 HG12 ' HB3' ' A' ' 6' ' ' TYR . 9.5 tt 48.57 29.75 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.511 1.125 . . . . 0.0 112.408 174.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 71.3 mtp180 -56.01 -34.2 65.59 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.387 -177.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.53 -48.01 69.44 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.556 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.697 ' HB3' HG12 ' A' ' 3' ' ' ILE . 2.8 t80 -57.55 -47.11 82.94 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.169 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.402 ' N ' HD22 ' A' ' 7' ' ' ASN . 0.9 OUTLIER -52.78 -68.11 0.2 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.731 -177.367 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -54.63 -67.65 0.25 Allowed 'General case' 0 C--O 1.238 0.462 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.343 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.55 -58.67 7.3 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.728 -171.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -66.4 -56.74 9.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.749 -172.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.631 ' SD ' ' HD2' ' A' ' 65' ' ' PHE . 10.5 mmt -59.63 -49.99 75.63 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.793 0.33 . . . . 0.0 110.663 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.13 -51.8 49.54 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.994 0.426 . . . . 0.0 111.291 -175.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.5 mtt180 -82.47 -6.99 59.64 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.993 -170.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -91.7 -52.54 4.71 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.402 HD23 ' O ' ' A' ' 11' ' ' MET . 4.0 mm? -72.65 -15.59 61.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.289 -176.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -48.4 -41.03 27.81 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.859 0.838 . . . . 0.0 109.51 170.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.4 ' HG3' ' HD2' ' A' ' 20' ' ' LYS . 30.1 tt0 -68.19 -40.23 82.28 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.963 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 3.3 m95 -60.49 -41.44 94.25 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 120.86 0.362 . . . . 0.0 110.776 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -60.69 -47.01 88.17 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.559 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.6 tmtt? -52.3 -44.57 65.1 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.443 177.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.403 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 30.5 m-20 -67.18 -45.96 75.4 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 120.641 0.257 . . . . 0.0 111.393 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -58.32 -41.53 84.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.826 0.346 . . . . 0.0 110.678 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 22.0 m-20 -67.76 -36.1 79.9 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.782 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.8 mt -58.39 -43.42 86.44 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 175.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -37.59 87.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 37.5 tt0 -56.55 -22.39 32.99 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.91 174.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.73 31.78 14.7 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.27 -0.49 . . . . 0.0 112.34 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -141.22 129.3 22.05 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--O 1.235 0.335 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.53 -179.971 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 109' ' ' LEU . 2.2 tm? . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.509 0.671 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.655 ' SD ' ' HG3' ' A' ' 108' ' ' MET . 50.5 mtm -133.38 136.35 45.24 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 166.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.461 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 60.4 mtt -118.53 117.65 29.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.951 0.405 . . . . 0.0 111.196 -174.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.631 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 16.6 m-85 -90.06 101.61 14.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 172.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 16.6 t -92.56 106.7 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.639 0.257 . . . . 0.0 111.264 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.601 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 87.7 m -83.06 108.28 16.24 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.65 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 42.7 t -100.97 -60.75 2.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.978 0.418 . . . . 0.0 111.523 -174.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.597 ' HB3' ' HB3' ' A' ' 76' ' ' GLU . 77.7 p -92.9 -60.33 1.83 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.3 19.99 79.79 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -164.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.483 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 8.8 t30 -127.34 133.18 24.79 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 115.19 -0.505 . . . . 0.0 109.822 -176.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 20.5 Cg_exo -65.0 -18.99 63.68 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 123.249 2.633 . . . . 0.0 114.704 -170.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.484 ' O ' ' HG2' ' A' ' 76' ' ' GLU . 40.7 p -61.61 133.42 55.62 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.103 0.478 . . . . 0.0 111.769 -176.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.78 -29.17 70.51 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -177.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.563 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 3.4 mptp? -52.97 -37.75 61.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.864 -176.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 69' ' ' SER . 5.3 mm-40 -55.04 -68.4 0.19 Allowed 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.821 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.5 t -64.4 -38.38 90.82 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.921 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.56 -61.66 2.34 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 120.765 0.317 . . . . 0.0 110.575 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 49.5 mt-10 -60.87 -50.01 75.15 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.247 -175.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.663 HD12 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -64.57 -43.7 96.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.088 -173.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 88.3 m -64.78 -34.27 77.95 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 120.635 0.255 . . . . 0.0 110.359 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -62.57 -40.2 96.11 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.663 HD12 HD12 ' A' ' 80' ' ' ILE . 82.3 mt -60.53 -45.75 92.67 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.132 0.491 . . . . 0.0 110.143 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.624 ' HZ3' ' HB3' ' A' ' 105' ' ' ALA . 44.3 m0 -60.79 -57.35 13.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.718 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.533 ' O ' ' HB2' ' A' ' 89' ' ' PHE . 26.0 tt0 -61.51 -23.6 66.03 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.075 0.464 . . . . 0.0 110.484 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.47 -31.89 58.38 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.026 175.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.2 m -94.23 -63.42 1.19 Allowed 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.492 HD21 HG13 ' A' ' 118' ' ' ILE . 6.1 mp -62.23 -46.99 86.37 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -173.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.533 ' HB2' ' O ' ' A' ' 85' ' ' GLN . 33.8 m-85 -71.36 -11.32 60.84 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.467 -178.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -70.46 -46.3 64.09 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 173.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.79 -10.17 59.21 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.977 173.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.7 t30 72.59 48.42 0.22 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.14 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -74.36 100.83 3.89 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -73.39 84.38 1.46 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.43 0.633 . . . . 0.0 110.933 -175.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.79 HG12 HD21 ' A' ' 109' ' ' LEU . 4.5 m -111.29 162.01 9.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.115 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.468 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.1 tp60 -101.32 103.79 14.78 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 173.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.597 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.1 OUTLIER -102.04 130.16 48.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.439 -175.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -119.63 136.44 54.39 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.6 tt -118.65 107.07 20.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.281 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.0 p -154.48 139.87 10.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.07 103.23 0.13 Allowed Glycine 0 C--O 1.224 -0.488 0 C-N-CA 120.342 -0.933 . . . . 0.0 111.584 -176.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 p -46.85 -35.27 6.17 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.549 ' HB2' HG21 ' A' ' 3' ' ' ILE . 12.7 t70 -53.23 -38.96 63.41 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.601 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 51.7 mtt180 -138.31 167.43 21.88 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 122.182 0.991 . . . . 0.0 112.821 -167.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.624 ' HB3' ' HZ3' ' A' ' 84' ' ' TRP . . . -143.88 153.84 42.74 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 113.888 -1.506 . . . . 0.0 107.543 162.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.437 HG12 ' SD ' ' A' ' 108' ' ' MET . 12.4 tt -127.0 145.56 34.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -170.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -122.34 120.11 33.06 Favored 'General case' 0 CA--C 1.523 -0.063 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.978 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.655 ' HG3' ' SD ' ' A' ' 63' ' ' MET . 4.3 mpp? -103.45 124.09 48.08 Favored 'General case' 0 C--O 1.24 0.604 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 173.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.79 HD21 HG12 ' A' ' 95' ' ' VAL . 9.1 mt -128.46 141.21 51.47 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.406 0.622 . . . . 0.0 111.479 -177.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 15.1 mtp-105 -105.91 6.28 31.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.255 171.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -139.31 138.75 36.97 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 177.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -121.57 24.96 7.06 Favored Glycine 0 N--CA 1.453 -0.2 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.474 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.0 m -60.3 -37.75 81.51 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.243 0.544 . . . . 0.0 110.482 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -117.13 24.96 10.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.853 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.07 -47.51 82.63 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.201 0.524 . . . . 0.0 111.061 -178.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -76.72 -20.1 56.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.175 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.14 -48.88 31.76 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.245 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.492 HG13 HD21 ' A' ' 88' ' ' LEU . 8.4 tt -63.5 -41.19 91.81 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.07 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.461 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 63.9 tttm -58.83 -45.27 90.42 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.268 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.3 -40.73 87.11 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.29 177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -65.11 -44.2 89.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 77.1 mt -60.74 -38.63 85.79 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.369 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 31.2 m -87.38 -12.0 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-O 120.853 0.358 . . . . 0.0 111.174 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 17.7 t -86.77 2.05 50.15 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.383 175.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.554 HE22 ' HZ2' ' A' ' 84' ' ' TRP . 58.5 mt-30 -60.75 164.31 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.149 -176.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -54.44 -61.64 2.18 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.32 178.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -80.95 -11.28 59.6 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.55 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 60.0 m 65.77 114.62 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.087 0.555 . . . . 0.0 110.979 -177.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -102.61 144.9 30.42 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.914 -177.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -91.61 127.25 36.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.974 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 43.6 t -106.53 109.86 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.254 -174.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.503 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 31.4 p -92.7 127.12 38.09 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.47 HD12 ' HG2' ' A' ' 137' ' ' MET . 83.0 mt -87.19 163.17 17.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.926 0.393 . . . . 0.0 111.593 -172.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 63' ' ' MET . 62.2 tt0 -59.83 116.49 4.13 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.333 -0.848 . . . . 0.0 111.412 176.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 72.01 -73.53 0.85 Allowed Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.94 -0.573 . . . . 0.0 113.368 173.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -161.08 154.93 22.34 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -177.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.47 ' HG2' HD12 ' A' ' 133' ' ' LEU . 85.8 mtp -62.34 110.73 1.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.842 0.354 . . . . 0.0 110.443 176.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.629 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 35.1 p90 -72.07 -31.48 1.73 Allowed Pre-proline 0 CA--C 1.547 0.83 0 CA-C-O 118.8 -0.619 . . . . 0.0 112.659 177.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.629 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 37.0 Cg_endo -65.27 123.96 12.27 Favored 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 121.197 1.264 . . . . 0.0 111.155 173.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 105.87 153.02 20.69 Favored Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 C--O 1.237 0.412 0 CA-C-O 120.678 0.275 . . . . 0.0 110.424 -179.379 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 112.101 -0.4 . . . . 0.0 112.101 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -113.08 108.56 17.49 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt -78.36 -2.81 5.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.105 -176.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -56.64 -38.78 72.6 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.841 -178.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -57.77 -49.27 77.15 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 177.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -55.72 -43.31 76.41 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.954 174.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.448 ' OD1' ' HD2' ' A' ' 104' ' ' ARG . 0.9 OUTLIER -58.46 -53.34 59.39 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.151 -177.254 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -52.68 -61.56 2.21 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.84 -61.45 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.509 -175.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -57.78 -60.0 4.36 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.075 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.441 ' O ' HD23 ' A' ' 15' ' ' LEU . 26.2 mmt -59.4 -52.1 67.08 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.226 -174.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.72 89.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.794 0.33 . . . . 0.0 111.084 -175.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -72.15 -23.94 61.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.748 -174.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.1 tp -80.71 -52.69 7.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.94 0.4 . . . . 0.0 110.625 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.441 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -68.08 -20.61 64.96 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.432 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -48.78 -38.28 21.48 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.504 0.668 . . . . 0.0 109.873 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -69.16 -43.68 73.78 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.002 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 11.7 m95 -59.04 -41.86 88.84 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 120.897 0.38 . . . . 0.0 110.715 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -61.71 -46.28 90.33 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.465 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.5 tmtt? -55.77 -40.88 73.24 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.439 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.438 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 7.4 m-20 -71.03 -44.67 65.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 111.736 0.272 . . . . 0.0 111.736 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -63.33 -31.6 72.8 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 121.169 0.509 . . . . 0.0 109.808 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 6.2 m-20 -66.62 -44.98 80.6 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.766 174.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 20' ' ' LYS . 54.3 mt -61.26 -34.18 59.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -69.09 -31.33 69.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.004 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 9.0 tp10 -64.99 -17.85 64.79 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.262 0.553 . . . . 0.0 110.071 170.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.68 29.42 13.6 Favored Glycine 0 N--CA 1.452 -0.261 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.239 -178.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -136.93 126.14 24.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 177.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.446 HD22 ' N ' ' A' ' 29' ' ' LEU . 2.9 mm? . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.629 ' HB3' ' HB2' ' A' ' 109' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.257 0 CA-C-O 121.161 0.505 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 13.5 ptm -145.21 116.06 7.77 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.551 175.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 67.0 mtt -120.23 144.77 47.57 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.55 -174.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' HB3' ' HD3' ' A' ' 104' ' ' ARG . 41.6 m-85 -123.75 100.31 6.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.954 177.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.584 HG21 HD13 ' A' ' 122' ' ' LEU . 16.3 t -91.96 109.73 21.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -171.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 57.9 m -79.91 104.69 10.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.07 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.429 HG11 HG12 ' A' ' 80' ' ' ILE . 25.5 t -101.86 -58.82 3.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.049 0.452 . . . . 0.0 111.193 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.721 ' HB2' ' HA ' ' A' ' 103' ' ' ASP . 5.1 m -65.44 -69.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.217 -170.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.21 3.66 89.72 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.45 -0.66 . . . . 0.0 111.45 -171.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.457 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 10.0 t30 -123.13 136.16 26.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 33.6 Cg_exo -60.35 -19.34 57.78 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.284 2.656 . . . . 0.0 114.301 -173.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.454 ' H ' ' ND2' ' A' ' 71' ' ' ASN . 6.4 m -81.63 140.96 34.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 122.24 -0.287 . . . . 0.0 110.446 -178.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -72.75 -19.67 61.33 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -171.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -32.16 -61.02 0.26 Allowed 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 121.616 0.722 . . . . 0.0 112.29 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.41 -51.98 63.48 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.617 -169.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.581 HG23 HD11 ' A' ' 99' ' ' ILE . 9.6 t -66.04 -33.97 77.01 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.83 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.21 -52.63 57.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.897 0.38 . . . . 0.0 110.126 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -57.1 -49.4 76.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.104 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.559 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.1 tp -67.52 -42.96 87.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -175.11 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.408 HG21 ' HB ' ' A' ' 99' ' ' ILE . 73.4 m -68.7 -25.13 64.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.685 0.279 . . . . 0.0 110.405 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.8 t -67.31 -48.52 67.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 173.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.486 HD12 HD12 ' A' ' 80' ' ' ILE . 86.1 mt -55.24 -43.7 74.81 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.335 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.633 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 53.8 m0 -67.01 -43.83 81.9 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.118 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -55.16 -28.83 55.71 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.365 0.602 . . . . 0.0 109.592 175.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -76.26 -68.2 1.57 Allowed Glycine 0 CA--C 1.518 0.233 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.225 176.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.7 m -57.54 -54.4 47.24 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.3 mp -64.1 -29.0 70.16 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 111.281 -172.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -101.29 6.24 42.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.475 0.655 . . . . 0.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -89.68 -32.33 17.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 167.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.56 -14.39 37.76 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.637 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.0 m120 66.51 80.33 0.22 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.269 176.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -111.58 120.71 43.02 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.793 171.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.42 83.03 1.95 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.239 0.542 . . . . 0.0 110.254 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.624 HG23 ' HD2' ' A' ' 97' ' ' ARG . 12.5 m -111.07 148.78 14.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.852 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.447 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.5 tp60 -100.79 100.56 11.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.785 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -125.67 141.23 52.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.204 -169.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.46 ' O ' HG22 ' A' ' 106' ' ' ILE . 81.5 m-85 -138.72 135.63 34.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.304 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.581 HD11 HG23 ' A' ' 77' ' ' THR . 5.0 tt -87.0 89.76 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.536 0.684 . . . . 0.0 109.445 173.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -135.28 130.71 51.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.307 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 93.83 103.43 1.7 Allowed Glycine 0 C--O 1.225 -0.465 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -171.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.2 m -40.9 -34.9 0.45 Allowed 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.721 ' HA ' ' HB2' ' A' ' 69' ' ' SER . 7.8 p-10 -89.56 -48.4 7.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.521 0.2 . . . . 0.0 111.472 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.529 ' HD3' ' HB3' ' A' ' 65' ' ' PHE . 61.6 mtt180 -88.51 155.0 19.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 114.233 1.197 . . . . 0.0 114.233 -173.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -128.35 140.72 51.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 113.806 -1.543 . . . . 0.0 107.379 165.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.46 HG22 ' O ' ' A' ' 98' ' ' PHE . 8.0 tt -109.69 132.09 58.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.009 0.433 . . . . 0.0 111.433 -172.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -123.22 107.69 11.98 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.261 176.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.419 ' SD ' HD11 ' A' ' 15' ' ' LEU . 66.5 mtm -102.1 118.81 37.68 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.52 176.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 62' ' ' LEU . 28.6 mt -110.89 131.39 55.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.436 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 29.8 mmm-85 -88.99 4.26 48.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.347 0.594 . . . . 0.0 109.601 173.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -146.13 135.08 22.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.336 176.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -114.11 23.54 12.65 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.99 -176.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.2 t -64.67 -44.87 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -101.61 26.52 7.25 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.005 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -50.38 72.88 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.131 0.491 . . . . 0.0 111.753 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -73.11 -28.54 62.33 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.679 -177.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -69.02 -48.41 63.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.42 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.587 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.2 tt -63.93 -41.41 92.41 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 178.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.497 ' HG2' HG11 ' A' ' 131' ' ' VAL . 14.1 tmtt? -57.56 -49.88 74.92 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 121.05 0.452 . . . . 0.0 110.229 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -56.65 -40.79 76.08 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.553 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -66.14 -47.71 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.918 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 88.8 mt -53.46 -44.77 69.18 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.403 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 28.7 m -81.77 -14.68 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.734 0.302 . . . . 0.0 111.481 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 39.4 t -74.26 1.55 11.17 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 122.769 0.427 . . . . 0.0 111.633 175.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.633 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.4 mp0 -76.85 164.53 25.73 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.401 0.619 . . . . 0.0 112.408 -174.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -79.76 -45.67 18.42 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.567 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -66.84 -3.17 6.22 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.726 -179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 43.6 t 62.51 91.32 0.07 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.222 0.534 . . . . 0.0 110.403 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.16 132.69 45.38 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.537 -177.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -108.27 124.53 50.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.841 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.508 ' HA ' ' HA ' ' A' ' 66' ' ' VAL . 6.5 p -102.84 127.97 56.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.103 0.478 . . . . 0.0 111.735 -173.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.6 m -87.06 121.33 29.37 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 2.2 tt -105.2 113.45 27.05 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -172.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -120.11 151.36 39.17 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.068 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 112.92 43.32 0.87 Allowed Glycine 0 N--CA 1.454 -0.137 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.099 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 70.35 144.47 0.06 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.331 0.586 . . . . 0.0 111.155 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 29.3 mmt -90.15 110.02 21.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.275 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.638 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 75.3 m-85 -58.55 -51.47 81.62 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.821 178.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.638 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 47.4 Cg_endo -91.5 179.21 1.57 Allowed 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 122.467 2.111 . . . . 0.0 112.309 177.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 86.37 -77.27 2.04 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.306 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 85.2 tttt . . . . . 0 C--O 1.236 0.371 0 CA-C-O 120.631 0.253 . . . . 0.0 110.558 -178.139 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 111.748 -0.541 . . . . 0.0 111.748 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -94.61 -54.99 3.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.211 0.529 . . . . 0.0 109.779 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.0 mm -94.16 -31.65 4.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.007 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -56.41 -50.54 71.33 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.588 0.233 . . . . 0.0 111.609 -178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -55.86 -48.97 74.59 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.67 -47.84 73.1 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.176 176.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.575 ' O ' ' HB2' ' A' ' 11' ' ' MET . 93.4 m-20 -53.12 -76.41 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.947 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.64 -64.07 0.94 Allowed 'General case' 0 C--O 1.24 0.588 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.832 -176.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.548 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -65.59 -61.24 2.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.846 -171.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -74.95 -30.49 61.23 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -168.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.575 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 10.0 mmt -71.42 -37.43 71.48 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.222 175.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.92 -48.08 83.15 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.16 173.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 85.7 mtt180 -59.05 -45.31 91.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.188 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.509 HD21 ' HD2' ' A' ' 98' ' ' PHE . 61.3 tp -71.1 -53.2 15.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.853 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.465 HD23 ' O ' ' A' ' 11' ' ' MET . 4.1 mm? -69.12 -18.59 63.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.129 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -48.74 -49.95 35.91 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.021 0.439 . . . . 0.0 110.799 175.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.452 ' HG3' ' N ' ' A' ' 18' ' ' TRP . 7.1 pt20 -66.71 -35.22 79.61 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.548 -177.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.466 ' CH2' ' HG2' ' A' ' 108' ' ' MET . 76.8 m95 -67.03 -42.24 85.2 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.088 0.471 . . . . 0.0 110.428 -177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.07 -48.89 79.94 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.581 ' O ' HG13 ' A' ' 24' ' ' ILE . 88.2 tttt -57.59 -45.75 84.9 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.668 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -58.13 -54.16 50.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.984 0.421 . . . . 0.0 110.846 -177.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -58.54 -39.36 79.98 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.669 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 4.0 m-20 -72.56 -30.73 64.68 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.514 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 20' ' ' LYS . 67.9 mt -65.11 -37.75 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -73.91 -26.7 60.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.547 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 4.9 mm-40 -62.14 -17.32 57.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.233 166.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.46 9.76 62.75 Favored Glycine 0 N--CA 1.453 -0.203 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.824 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.91 124.96 47.3 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 C--N 1.327 -0.379 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' HG ' ' A' ' 109' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.425 0 CA-C-O 121.901 0.858 . . . . 0.0 113.254 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.609 ' HE3' ' HG3' ' A' ' 134' ' ' GLU . 72.9 mtm -142.32 133.66 26.36 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.307 168.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.53 ' HE1' ' HB2' ' A' ' 119' ' ' LYS . 63.0 mtt -114.64 129.15 56.64 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -172.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.518 ' HE1' ' HA ' ' A' ' 134' ' ' GLU . 43.5 m-85 -91.1 116.46 28.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 168.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.8 t -112.96 108.2 24.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.665 0.269 . . . . 0.0 110.965 -173.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 37.8 m -77.15 106.52 8.92 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.418 HG21 HG23 ' A' ' 77' ' ' THR . 97.9 t -85.24 -61.05 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.081 0.467 . . . . 0.0 111.682 -172.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.5 t -91.65 -41.61 10.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.931 -171.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.56 -10.18 65.41 Favored Glycine 0 C--N 1.33 0.243 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -167.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.579 HD21 HG23 ' A' ' 73' ' ' THR . 8.2 t30 -126.23 130.82 23.85 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 123.865 0.866 . . . . 0.0 109.004 178.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 80.0 Cg_exo -46.3 -16.61 0.25 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.185 3.257 . . . . 0.0 116.263 -171.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.579 HG23 HD21 ' A' ' 71' ' ' ASN . 19.9 p -60.18 97.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.682 0.674 . . . . 0.0 112.347 -172.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.413 ' CA ' ' HB3' ' A' ' 102' ' ' SER . 40.0 tt0 -43.34 -30.92 0.57 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.132 -0.94 . . . . 0.0 112.415 176.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 85.0 mttt -35.04 -66.9 0.16 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 123.998 0.811 . . . . 0.0 111.935 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -62.93 -43.75 97.94 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.975 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.418 HG23 HG21 ' A' ' 68' ' ' VAL . 38.6 m -63.93 -39.8 94.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.282 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.54 -50.01 60.64 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.384 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.84 -54.16 45.97 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 120.985 0.422 . . . . 0.0 110.929 177.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.635 HD12 HD12 ' A' ' 83' ' ' LEU . 10.2 tp -67.07 -40.0 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.324 -174.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.461 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 70.5 m -61.48 -37.34 83.26 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.673 0.273 . . . . 0.0 110.394 176.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.401 ' HA ' HE21 ' A' ' 85' ' ' GLN . 50.9 m -61.02 -44.84 96.82 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.635 HD12 HD12 ' A' ' 80' ' ' ILE . 78.3 mt -58.53 -47.48 84.04 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 176.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.726 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 48.9 m0 -58.7 -45.87 88.56 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.093 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 81' ' ' THR . 47.6 mt-30 -58.51 -60.03 4.44 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -46.44 -40.06 10.73 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.342 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 25.1 m -73.17 -58.02 3.61 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 111.373 -178.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.3 mt -57.99 -54.14 50.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -174.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 39.5 m-85 -65.94 -31.13 71.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.38 -174.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -73.66 -24.07 59.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.282 0.563 . . . . 0.0 109.723 176.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.13 14.4 12.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.43 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.5 t30 73.26 9.46 5.2 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.703 175.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -81.28 91.92 6.29 Favored 'General case' 0 C--O 1.236 0.369 0 O-C-N 122.038 -0.413 . . . . 0.0 109.968 176.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.77 94.46 7.63 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.08 165.25 16.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.316 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.499 ' HB3' ' HB2' ' A' ' 108' ' ' MET . 6.1 tp60 -104.53 152.97 21.74 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 177.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.538 ' HD3' ' N ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -155.65 126.82 7.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.78 0.324 . . . . 0.0 110.36 -177.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.509 ' HD2' HD21 ' A' ' 14' ' ' LEU . 15.8 m-30 -113.82 124.15 51.53 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 tt -102.32 88.77 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 122.136 0.97 . . . . 0.0 109.734 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.2 p -128.39 141.98 45.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 114.534 -1.212 . . . . 0.0 108.111 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 67.19 76.27 0.39 Allowed Glycine 0 C--O 1.224 -0.489 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -169.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.413 ' HB3' ' CA ' ' A' ' 74' ' ' GLU . 24.6 m -35.21 -34.6 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -165.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.76 -34.17 72.63 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.176 0.513 . . . . 0.0 111.849 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 88.3 mtt180 -128.09 134.69 49.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.162 0.506 . . . . 0.0 111.93 -171.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -106.64 128.56 54.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.539 -0.755 . . . . 0.0 108.975 173.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.6 tt -104.46 133.14 49.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 120.91 0.386 . . . . 0.0 110.704 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -116.11 129.62 56.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.07 -177.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.573 ' HA ' ' HG2' ' A' ' 63' ' ' MET . 2.0 mpt? -108.87 122.71 47.77 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.679 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' A' ' 62' ' ' LEU . 0.8 OUTLIER -128.01 114.75 17.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 172.1 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -61.79 -34.32 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 -170.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -118.38 111.49 18.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.101 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.54 48.46 3.9 Favored Glycine 0 C--N 1.332 0.318 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.166 -174.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.4 t -68.39 -71.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.981 0.419 . . . . 0.0 110.003 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.1 p90 -80.54 30.17 0.3 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.631 177.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.82 -41.53 82.42 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.234 0.54 . . . . 0.0 111.445 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.413 ' HA ' ' HE3' ' A' ' 119' ' ' LYS . 21.0 m95 -75.11 -32.89 61.52 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.009 -174.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.83 -53.57 44.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.153 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.592 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.2 tt -61.62 -38.36 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.079 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.53 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 24.5 ttpp -53.51 -55.55 24.48 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.144 0.497 . . . . 0.0 110.788 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.668 ' HA ' HG22 ' A' ' 123' ' ' VAL . 3.3 m-20 -64.22 -30.99 72.02 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.846 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -64.93 -36.51 84.6 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.959 0.409 . . . . 0.0 110.034 176.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 81.3 mt -67.43 -46.26 73.67 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.278 178.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.668 HG22 ' HA ' ' A' ' 120' ' ' ASP . 12.5 m -82.21 -4.51 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.582 -177.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.4 t -70.04 1.24 4.82 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.92 0.488 . . . . 0.0 111.765 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.726 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -83.19 143.11 30.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.007 0.432 . . . . 0.0 111.529 -174.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -43.89 -62.35 1.15 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.077 -0.965 . . . . 0.0 112.063 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 48.9 ttt180 -80.78 21.24 0.69 Allowed 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -175.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 56.6 m 70.99 -166.94 0.15 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.701 0.4 . . . . 0.0 111.779 174.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 171.71 119.41 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.603 -176.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 34.8 mt-10 -87.17 144.14 26.98 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.2 p -138.72 139.72 40.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.926 0.393 . . . . 0.0 111.302 -177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 18.2 p -138.33 140.47 39.51 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 176.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 137' ' ' MET . 61.3 mt -88.4 154.31 20.48 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.639 0.257 . . . . 0.0 111.172 -176.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.609 ' HG3' ' HE3' ' A' ' 63' ' ' MET . 1.7 tm-20 -69.0 138.71 54.75 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 70.3 17.11 73.91 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.629 -172.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 74.61 167.25 0.29 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.745 0.818 . . . . 0.0 110.999 -178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.443 ' HA ' HD12 ' A' ' 133' ' ' LEU . 27.1 ttt -60.57 107.03 0.62 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.622 -179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.52 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 37.0 m-85 -55.44 -52.39 72.07 Favored Pre-proline 0 CA--C 1.542 0.635 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.052 -176.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.52 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 72.5 Cg_endo -76.01 127.08 9.75 Favored 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 121.842 1.695 . . . . 0.0 111.994 179.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 110.77 -121.63 5.93 Favored Glycine 0 C--N 1.331 0.301 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt . . . . . 0 C--O 1.235 0.303 0 CA-C-O 120.658 0.266 . . . . 0.0 110.439 -178.887 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -80.38 55.62 2.31 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.199 0.524 . . . . 0.0 110.938 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.778 HG12 ' HB3' ' A' ' 6' ' ' TYR . 15.0 tt -82.59 40.61 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 CA-C-O 122.316 1.055 . . . . 0.0 109.039 176.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -55.41 -43.41 75.25 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 114.495 -1.23 . . . . 0.0 112.274 -169.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -53.98 -46.13 71.59 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.082 -177.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.778 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.3 OUTLIER -58.57 -47.15 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.989 176.656 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.571 ' O ' ' HB2' ' A' ' 11' ' ' MET . 90.6 m-20 -55.15 -71.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.405 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -51.23 -69.47 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.093 -178.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.17 -58.75 7.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.746 -171.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -72.96 -45.97 55.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.915 -168.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.571 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 17.2 mmt -69.01 -43.27 75.14 Favored 'General case' 0 N--CA 1.461 0.125 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.707 -176.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' GLU . . . -65.47 -49.94 67.19 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.835 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -67.95 -27.81 66.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.653 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -78.78 -52.09 8.86 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.891 0.377 . . . . 0.0 111.2 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 11' ' ' MET . 4.3 mm? -72.55 -25.13 61.25 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -173.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -59.75 -29.45 68.17 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 179.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -55.8 -58.11 9.21 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.854 174.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.1 m95 -58.94 -30.15 67.67 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.667 -178.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -60.82 -62.89 1.53 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.379 175.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.478 ' O ' HG13 ' A' ' 24' ' ' ILE . 12.1 ttmt -57.37 -47.14 82.42 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.152 -178.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.42 -46.49 73.21 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 123.377 0.423 . . . . 0.0 110.632 -178.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 28.6 t70 -61.64 -41.9 98.14 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.141 176.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -66.89 -24.87 66.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.08 178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 20' ' ' LYS . 70.5 mt -71.28 -37.5 66.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 174.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -68.34 -31.55 71.02 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.571 173.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 22' ' ' ASP . 14.9 mm-40 -69.21 -35.38 76.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.349 0.595 . . . . 0.0 109.645 172.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.64 48.02 Favored Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.726 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -116.88 94.2 4.5 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.434 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.2 mm? . . . . . 0 CA--C 1.533 0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.027 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--O 1.235 0.296 0 CA-C-O 121.062 0.458 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.677 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 17.1 ptm -140.87 111.74 7.07 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.867 176.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.5 mtt -113.47 130.21 56.38 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.385 -174.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -100.05 118.86 37.31 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.442 HG22 HG13 ' A' ' 131' ' ' VAL . 35.4 t -113.94 101.7 12.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 -175.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.645 HG23 ' HB2' ' A' ' 130' ' ' GLU . 5.1 t -83.19 106.2 14.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 109.459 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.438 HG11 HG12 ' A' ' 80' ' ' ILE . 17.3 t -101.29 -60.78 2.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.831 -173.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.3 t -72.57 -59.7 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.685 -176.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.508 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 75.62 0.92 64.57 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.523 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.459 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . 9.1 t30 -126.26 132.29 24.26 Favored Pre-proline 0 CA--C 1.535 0.367 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 71' ' ' ASN . 32.6 Cg_exo -58.71 -17.91 38.2 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 123.628 2.886 . . . . 0.0 114.513 -171.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.441 HG23 HD21 ' A' ' 71' ' ' ASN . 36.1 p -57.9 107.16 0.43 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.055 0.455 . . . . 0.0 111.912 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -47.61 -31.27 4.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.04 0.936 . . . . 0.0 112.641 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.618 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 11.9 mptt -49.29 -50.88 37.17 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.135 0.493 . . . . 0.0 111.081 -177.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -59.3 -50.33 74.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.452 -174.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.456 HG23 HD11 ' A' ' 99' ' ' ILE . 14.6 t -67.83 -39.47 83.88 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.793 -175.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -59.06 -53.3 59.91 Favored 'General case' 0 N--CA 1.457 -0.08 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -54.95 -63.13 1.25 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.135 179.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.438 HG12 HG11 ' A' ' 68' ' ' VAL . 11.4 tp -63.41 -46.35 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.599 -171.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.4 HG21 ' HB ' ' A' ' 99' ' ' ILE . 55.3 m -67.99 -31.72 71.62 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.488 -0.132 . . . . 0.0 111.159 -177.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.1 t -67.73 -44.45 77.57 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 177.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 99.3 mt -60.69 -40.94 94.05 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.508 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 40.1 m0 -62.98 -47.79 81.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.664 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.7 tt0 -55.73 -57.84 10.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.027 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -43.93 -58.34 4.33 Favored Glycine 0 C--N 1.333 0.395 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.991 173.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 49.8 m -57.35 -49.53 75.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.59 ' HB3' ' HB2' ' A' ' 93' ' ' TYR . 95.3 mt -60.71 -56.57 19.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.083 -177.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -68.34 -20.3 64.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.07 -177.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -68.73 -38.0 79.85 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.164 0.507 . . . . 0.0 110.197 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.8 5.72 50.2 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.224 175.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 64.64 65.12 0.64 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.596 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.59 ' HB2' ' HB3' ' A' ' 88' ' ' LEU . 17.4 m-85 -102.1 88.16 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 168.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -77.21 72.57 3.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 109.785 -177.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.856 HG12 HD21 ' A' ' 109' ' ' LEU . 4.5 m -104.62 161.02 4.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.015 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.467 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.4 tp60 -102.0 105.42 16.18 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 177.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.744 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.7 OUTLIER -119.96 145.35 46.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.972 -174.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.474 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 81.8 m-85 -130.97 127.01 37.52 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.068 0.461 . . . . 0.0 109.951 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.456 HD11 HG23 ' A' ' 77' ' ' THR . 7.5 tt -99.26 90.51 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.935 177.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -136.86 128.71 43.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.584 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 76.26 97.99 0.15 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 -172.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.9 m -45.19 -32.58 1.93 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -172.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.508 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 2.5 m-20 -57.47 -51.92 67.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.471 177.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.438 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 69.9 mtt180 -120.92 134.37 55.3 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -171.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -109.91 127.96 55.06 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 168.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.474 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 6.1 tt -98.71 132.94 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.989 0.423 . . . . 0.0 111.257 -177.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -124.22 123.8 41.05 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.593 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 76.6 mtm -128.12 146.81 50.59 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.267 0.556 . . . . 0.0 111.41 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.856 HD21 HG12 ' A' ' 95' ' ' VAL . 22.4 mt -133.28 137.64 46.1 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.436 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.37 -55.42 4.17 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 172.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -128.3 111.51 13.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.466 177.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -165.91 95.91 0.12 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.31 -0.948 . . . . 0.0 113.308 -176.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.5 t -70.66 -23.39 62.5 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 109.872 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.29 14.36 1.23 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.914 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.74 75.38 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.051 0.453 . . . . 0.0 111.529 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 16.8 m95 -79.49 -23.86 42.7 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.185 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -72.67 -48.45 39.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.881 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.566 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 9.1 tt -64.17 -41.29 91.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 175.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.6 -41.45 81.26 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 175.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.8 -40.8 94.04 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.153 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -60.66 -40.44 92.04 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.435 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 47.7 mt -65.96 -40.55 91.39 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.256 -178.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 24.6 m -81.07 -22.91 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 120.809 0.338 . . . . 0.0 111.245 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.5 m -87.17 2.7 49.11 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.127 0.489 . . . . 0.0 110.583 176.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.508 ' NE2' ' NE1' ' A' ' 84' ' ' TRP . 6.6 tp-100 -66.74 156.47 35.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.621 -174.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -45.16 -67.74 0.26 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.001 0.52 . . . . 0.0 111.879 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -69.77 -17.84 63.45 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.604 177.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 42.3 t 68.8 116.59 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.609 0.568 . . . . 0.0 109.919 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.59 143.28 32.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.934 -175.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.645 ' HB2' HG23 ' A' ' 67' ' ' THR . 38.9 mt-10 -91.66 113.39 25.64 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.01 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.442 HG13 HG22 ' A' ' 66' ' ' VAL . 37.5 t -104.25 138.73 27.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.361 -178.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.5 p -125.54 136.34 53.22 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.56 HD12 ' HG2' ' A' ' 137' ' ' MET . 62.4 mt -94.13 110.89 22.58 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.677 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 53.8 mm-40 -67.03 129.82 41.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.905 0.383 . . . . 0.0 110.263 -177.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 96.5 6.02 58.73 Favored Glycine 0 CA--C 1.518 0.222 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 -171.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 74.44 160.45 0.23 Allowed 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.908 0.883 . . . . 0.0 111.709 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.56 ' HG2' HD12 ' A' ' 133' ' ' LEU . 76.9 mtp -69.58 101.32 1.6 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.299 -177.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.667 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 35.7 p90 -73.69 -28.36 0.91 Allowed Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.312 173.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.667 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 37.9 Cg_endo -66.2 118.34 5.43 Favored 'Trans proline' 0 C--N 1.369 1.617 0 C-N-CA 121.455 1.437 . . . . 0.0 111.309 171.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 81.33 -126.2 7.27 Favored Glycine 0 C--N 1.332 0.31 0 N-CA-C 111.454 -0.658 . . . . 0.0 111.454 -177.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 N--CA 1.466 0.372 0 CA-C-N 116.944 0.372 . . . . 0.0 110.363 177.676 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.78 0 N-CA-C 111.753 -0.539 . . . . 0.0 111.753 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -120.58 166.41 13.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.977 0.417 . . . . 0.0 110.83 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 tt -107.55 11.92 8.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 121.969 0.89 . . . . 0.0 108.796 174.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 43.5 ttm105 -51.95 -31.79 30.41 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.524 -176.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -54.73 -45.6 74.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.627 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.0 -44.04 98.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 178.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.566 ' O ' ' HB2' ' A' ' 11' ' ' MET . 1.1 m-80 -53.77 -70.39 0.1 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -54.45 -62.68 1.5 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.935 -175.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.49 -64.27 1.0 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.758 -173.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -68.0 -39.44 83.23 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.672 -169.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.566 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 24.2 mmt -70.52 -45.99 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.979 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -59.65 -43.64 93.81 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.052 0.454 . . . . 0.0 110.484 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -72.54 -31.68 65.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.469 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.9 tp -71.59 -52.77 16.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.962 0.411 . . . . 0.0 110.29 177.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.76 -17.02 61.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.174 -177.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 16.5 tp10 -51.07 -49.75 60.04 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 121.268 0.556 . . . . 0.0 110.206 173.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.425 ' O ' ' N ' ' A' ' 21' ' ' ASP . 18.2 tt0 -64.93 -43.01 94.14 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.805 179.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 m95 -55.09 -41.88 72.16 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.612 0.57 . . . . 0.0 110.833 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.28 -52.32 66.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 173.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.649 ' HE2' HD11 ' A' ' 24' ' ' ILE . 88.2 tttt -62.22 -27.68 69.15 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.946 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 17' ' ' GLN . 35.6 m-20 -67.83 -49.39 62.47 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -72.27 -25.84 61.76 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.052 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -61.97 -54.6 39.45 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.285 0.564 . . . . 0.0 110.391 171.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.649 HD11 ' HE2' ' A' ' 20' ' ' LYS . 77.8 mt -59.17 -35.87 59.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.995 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.97 -42.64 99.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.195 178.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -78.2 3.29 15.62 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.034 0.445 . . . . 0.0 110.93 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.22 53.12 3.21 Favored Glycine 0 C--N 1.334 0.43 0 CA-C-N 116.236 -0.438 . . . . 0.0 113.95 172.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -158.64 136.2 10.21 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.034 0.417 . . . . 0.0 111.171 175.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.578 HD13 HG12 ' A' ' 24' ' ' ILE . 2.5 mm? . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 176.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.416 HD13 ' HB1' ' A' ' 115' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 121.719 0.771 . . . . 0.0 112.738 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.453 ' HG3' ' HB3' ' A' ' 134' ' ' GLU . 18.0 ptp -136.47 127.27 27.37 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 114.739 -1.118 . . . . 0.0 108.786 172.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 61.7 mtt -110.35 125.32 53.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.875 0.369 . . . . 0.0 111.344 -173.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.504 ' HE2' ' SD ' ' A' ' 11' ' ' MET . 49.8 m-85 -102.91 105.01 15.29 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.644 HG21 HD13 ' A' ' 122' ' ' LEU . 21.7 t -98.11 105.41 17.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.245 -171.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.8 m -79.02 103.5 9.01 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.63 HG11 HG12 ' A' ' 80' ' ' ILE . 26.0 t -96.18 -62.71 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.811 0.338 . . . . 0.0 111.739 -171.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.6 t -92.56 -64.3 1.12 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.426 -173.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 89.78 -9.25 77.86 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 -172.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -92.72 125.49 55.33 Favored Pre-proline 0 CA--C 1.532 0.273 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -62.38 -19.8 68.38 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 123.172 2.581 . . . . 0.0 114.21 -170.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.448 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.5 m -66.04 113.93 4.83 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 52.3 mt-10 -60.45 -24.65 65.39 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -168.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.534 ' HD3' ' N ' ' A' ' 76' ' ' GLU . 0.0 OUTLIER -49.96 -31.23 12.07 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.894 0.378 . . . . 0.0 111.593 -178.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.534 ' N ' ' HD3' ' A' ' 75' ' ' LYS . 31.6 mm-40 -60.37 -60.09 4.37 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.083 177.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.647 ' HB ' ' HA ' ' A' ' 102' ' ' SER . 15.1 t -62.82 -33.43 75.21 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.511 -178.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -54.94 -59.29 4.94 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.08 176.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -57.47 -54.54 45.71 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.149 -179.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.657 HD11 ' HG2' ' A' ' 125' ' ' GLN . 9.6 tp -63.91 -44.95 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.779 -171.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.436 HG21 ' HB ' ' A' ' 99' ' ' ILE . 39.5 m -67.03 -34.29 77.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.543 0.211 . . . . 0.0 110.61 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.2 t -63.62 -45.09 91.83 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.896 0.379 . . . . 0.0 110.201 176.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 95.6 mt -62.64 -44.73 95.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.553 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.402 ' NE1' ' NE2' ' A' ' 125' ' ' GLN . 20.8 m0 -65.37 -43.78 89.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.859 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -60.2 -29.71 68.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.313 0.578 . . . . 0.0 110.091 172.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -77.9 -26.12 61.02 Favored Glycine 0 N--CA 1.451 -0.307 0 CA-C-N 115.175 -0.92 . . . . 0.0 112.307 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 44.0 m -96.11 -56.26 2.7 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.96 -49.26 76.25 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.702 0.287 . . . . 0.0 111.597 -175.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -71.05 -21.62 62.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.769 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -73.25 -35.09 66.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.232 0.539 . . . . 0.0 109.762 174.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.65 7.32 34.09 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.481 176.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 65.82 70.39 0.44 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.463 178.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -130.3 95.77 3.99 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.293 171.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -84.16 70.87 10.61 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.615 0.721 . . . . 0.0 109.669 -179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 31.8 m -95.77 169.48 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.07 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.42 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -101.48 104.7 15.64 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 120.474 -0.49 . . . . 0.0 109.877 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.59 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.4 OUTLIER -111.51 138.49 47.97 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.25 -178.376 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.451 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 20.4 m-85 -130.0 150.85 51.1 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 175.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.436 ' HB ' HG21 ' A' ' 81' ' ' THR . 6.9 tt -130.75 96.81 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.399 -171.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.1 p -149.01 133.38 9.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 80.59 102.72 0.3 Allowed Glycine 0 C--O 1.227 -0.314 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.083 -173.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.647 ' HA ' ' HB ' ' A' ' 77' ' ' THR . 18.9 t -53.85 -28.27 34.85 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.913 0.387 . . . . 0.0 111.924 -174.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.584 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 10.0 p-10 -61.42 -36.84 81.45 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 178.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -134.39 141.2 46.77 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -171.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.54 137.75 53.01 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 167.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.451 ' CG2' ' HB2' ' A' ' 98' ' ' PHE . 10.2 tt -111.81 128.24 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-O 121.15 0.5 . . . . 0.0 111.633 -172.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -121.18 117.96 28.45 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.615 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.2 mtm -115.76 133.47 56.0 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.716 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 109' ' ' LEU . 4.2 mp -132.51 155.44 48.59 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.751 -176.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 110' ' ' ARG . 44.7 mtm105 -105.86 6.01 31.19 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 167.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -100.59 149.54 23.63 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.883 -177.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -131.36 19.16 4.87 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.583 -0.607 . . . . 0.0 111.583 175.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.9 t -93.98 -60.37 1.76 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.725 0.298 . . . . 0.0 110.222 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -99.07 8.26 45.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.937 0.398 . . . . 0.0 110.568 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.416 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -54.79 -38.03 66.79 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.21 178.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -76.11 -35.42 59.31 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.217 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -58.94 -52.5 65.48 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.406 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.6 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 4.3 tt -60.08 -42.53 90.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.34 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.471 ' HB3' ' HZ2' ' A' ' 119' ' ' LYS . 4.2 ttpm? -52.51 -54.88 26.62 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.344 0.592 . . . . 0.0 110.912 177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.61 ' HA ' HG22 ' A' ' 123' ' ' VAL . 2.6 m-20 -65.17 -31.02 72.0 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.875 -177.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -64.48 -45.1 88.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 176.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.644 HD13 HG21 ' A' ' 66' ' ' VAL . 74.5 mt -58.36 -45.19 88.67 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.852 177.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.61 HG22 ' HA ' ' A' ' 120' ' ' ASP . 14.3 m -77.5 -17.51 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.758 0.313 . . . . 0.0 111.539 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.2 t -81.1 2.38 27.59 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.983 178.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.657 ' HG2' HD11 ' A' ' 80' ' ' ILE . 6.3 tp-100 -68.01 163.32 22.53 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.092 -174.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -66.08 -46.21 78.52 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.208 0.527 . . . . 0.0 109.752 -176.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 38.9 mtt85 -70.29 -20.94 63.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.432 174.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.4 m 66.11 167.33 0.21 Allowed 'General case' 0 CA--C 1.534 0.332 0 O-C-N 123.716 0.635 . . . . 0.0 109.296 -167.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.48 146.56 6.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.844 0.354 . . . . 0.0 111.322 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -94.53 112.78 24.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.557 . . . . 0.0 109.553 176.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -96.55 112.34 28.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.218 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 65.3 p -95.43 132.16 40.8 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 67.7 mt -99.26 117.51 33.87 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -175.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.453 ' HB3' ' HG3' ' A' ' 63' ' ' MET . 10.8 tp10 -115.78 150.68 36.52 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.855 0.359 . . . . 0.0 110.54 -177.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 111.11 -81.46 0.29 Allowed Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 111.646 -0.582 . . . . 0.0 111.646 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -130.96 114.21 14.95 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.675 0.274 . . . . 0.0 110.591 179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.39 117.21 19.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.71 177.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.567 ' H ' ' HD2' ' A' ' 139' ' ' PRO . 23.1 m-85 -94.87 -51.79 0.24 Allowed Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -177.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.567 ' HD2' ' H ' ' A' ' 138' ' ' TYR . 27.3 Cg_endo -60.02 114.12 1.95 Allowed 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 122.139 1.892 . . . . 0.0 112.825 -174.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 72.0 -78.06 0.66 Allowed Glycine 0 C--N 1.333 0.399 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.502 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 23.8 pttm . . . . . 0 C--N 1.325 -0.472 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 -179.259 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 112.109 -0.396 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -68.94 -48.43 63.25 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.124 0.488 . . . . 0.0 110.657 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.654 HG21 ' HB2' ' A' ' 103' ' ' ASP . 16.0 tt -117.42 16.82 7.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-O 121.866 0.841 . . . . 0.0 109.498 -177.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.484 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 59.4 ttt-85 -59.55 -29.38 67.87 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.514 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -57.53 -46.5 83.77 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.457 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.1 OUTLIER -56.15 -44.33 79.17 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.702 173.223 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 4' ' ' ARG . 0.8 OUTLIER -53.45 -76.38 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -179.059 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.5 -59.83 4.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.485 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.571 ' O ' ' HG3' ' A' ' 13' ' ' ARG . . . -63.94 -57.16 10.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.905 -171.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -69.58 -45.06 69.54 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.771 -171.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.421 ' SD ' ' HD2' ' A' ' 65' ' ' PHE . 25.4 mmt -63.72 -37.59 87.91 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.1 -50.58 72.68 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.848 0.356 . . . . 0.0 110.394 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 9' ' ' ALA . 66.8 mtm180 -57.63 -45.5 85.33 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.268 -176.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -75.48 -52.23 11.17 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.537 -176.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.408 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -75.53 -15.95 60.33 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -172.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.62 -35.15 65.57 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 173.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.14 -42.04 99.41 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.485 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 45.2 m95 -61.44 -41.82 97.79 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.743 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.98 -42.74 94.28 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.503 ' O ' HG13 ' A' ' 24' ' ' ILE . 3.1 tttm -52.99 -52.09 59.47 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.048 176.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.432 ' N ' ' HG2' ' A' ' 20' ' ' LYS . 13.5 m-20 -69.45 -35.63 75.84 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.442 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -56.9 -48.93 77.05 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 174.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -62.39 -44.81 95.57 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.12 177.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 20' ' ' LYS . 64.5 mt -59.03 -42.21 85.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.723 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -79.88 -13.2 59.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.538 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.65 -11.75 61.09 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.48 0.657 . . . . 0.0 109.312 166.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.24 28.1 11.18 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.223 -0.898 . . . . 0.0 114.288 171.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -154.07 152.5 30.54 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 169.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.6 mm? . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.43 -177.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 HD13 ' A' ' 109' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.164 0.506 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.408 ' SD ' HD12 ' A' ' 15' ' ' LEU . 45.7 mtm -134.13 136.96 44.2 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 170.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.648 ' HG2' ' HG ' ' A' ' 133' ' ' LEU . 61.2 mtt -120.26 118.22 29.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.45 . . . . 0.0 111.185 -176.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' HD2' ' SD ' ' A' ' 11' ' ' MET . 13.1 m-85 -92.41 102.9 15.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 172.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.517 ' O ' ' HA ' ' A' ' 104' ' ' ARG . 18.6 t -94.22 105.03 16.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.156 -170.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 47.7 m -77.25 101.4 6.22 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.015 178.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.475 HG11 HG21 ' A' ' 80' ' ' ILE . 42.8 t -101.43 -60.67 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.755 -177.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.3 t -81.75 -68.07 0.73 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.845 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.661 ' H ' ' HA ' ' A' ' 103' ' ' ASP . . . 81.88 -10.71 51.15 Favored Glycine 0 CA--C 1.52 0.396 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 -169.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.416 ' ND2' ' OG1' ' A' ' 73' ' ' THR . 8.5 t30 -109.25 133.73 20.69 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -64.5 -17.37 59.39 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.98 2.453 . . . . 0.0 114.702 -169.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.416 ' OG1' ' ND2' ' A' ' 71' ' ' ASN . 41.0 p -60.36 112.0 1.78 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.338 0.517 . . . . 0.0 111.221 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.419 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 10.4 pt-20 -57.98 -15.59 9.49 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.872 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -47.16 -54.18 11.25 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.075 175.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -58.5 -55.73 31.22 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.276 -0.874 . . . . 0.0 110.884 -172.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.495 ' HA ' HG22 ' A' ' 80' ' ' ILE . 10.6 t -63.73 -31.87 73.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.592 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.49 -52.95 62.38 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.208 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -58.03 -54.78 43.08 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.046 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.609 HD11 ' HG2' ' A' ' 125' ' ' GLN . 10.8 tp -65.32 -42.83 94.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.318 -173.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 86.2 m -68.38 -28.07 66.78 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 120.675 0.274 . . . . 0.0 110.436 178.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 48.3 t -62.85 -48.76 77.64 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 73.9 mt -58.67 -52.36 66.03 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.098 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.652 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 51.8 m0 -63.13 -29.97 71.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.406 -177.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.26 -60.19 3.73 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -49.42 -33.11 16.13 Favored Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.25 -0.887 . . . . 0.0 113.671 177.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 20.0 m -84.05 -67.89 0.76 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.77 -56.55 13.19 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 112.112 -172.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -76.53 -15.16 59.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.641 -170.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -80.32 -23.87 40.33 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.65 10.6 22.56 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.719 177.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 18.0 m120 70.63 24.89 4.27 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.826 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -71.54 100.07 2.18 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 173.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -85.36 69.86 10.75 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.495 0.664 . . . . 0.0 110.366 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.4 HG12 ' HG ' ' A' ' 109' ' ' LEU . 24.4 m -107.47 159.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.024 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.406 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 6.8 tp60 -100.53 136.93 39.64 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 176.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.587 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -140.58 135.55 31.9 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.088 -169.304 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.415 ' O ' HG22 ' A' ' 106' ' ' ILE . 28.4 m-85 -130.46 132.37 45.65 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.587 174.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.483 HD11 HG23 ' A' ' 77' ' ' THR . 6.9 tt -109.69 89.75 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.705 0.764 . . . . 0.0 109.9 179.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -138.24 131.77 41.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.85 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.03 98.47 0.11 Allowed Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 -172.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.419 ' OG ' ' HA ' ' A' ' 74' ' ' GLU . 15.0 m -49.29 -27.76 4.14 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.984 0.514 . . . . 0.0 112.315 -174.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.661 ' HA ' ' H ' ' A' ' 70' ' ' GLY . 35.7 t70 -47.33 -47.37 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.561 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.517 ' HA ' ' O ' ' A' ' 66' ' ' VAL . 51.0 mtt180 -135.98 147.09 47.87 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.557 0.694 . . . . 0.0 112.616 -172.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -112.32 122.5 47.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 166.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.712 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.7 tt -98.49 133.63 40.14 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.74 -173.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -126.89 109.63 12.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.504 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.712 ' SD ' HG12 ' A' ' 106' ' ' ILE . 3.5 mpp? -96.8 124.57 40.82 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 178.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.422 HD13 HD12 ' A' ' 62' ' ' LEU . 6.0 mp -111.72 102.98 11.24 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.55 -32.88 62.57 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 176.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -141.63 126.89 18.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.722 -1.126 . . . . 0.0 109.173 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 167.11 118.4 0.44 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.521 -0.847 . . . . 0.0 113.161 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.5 m -81.25 -18.86 44.52 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -79.57 33.7 0.26 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.11 -175.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.421 ' O ' HG22 ' A' ' 118' ' ' ILE . . . -61.95 -59.5 5.02 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.135 0.493 . . . . 0.0 111.857 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -26.94 64.06 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.884 0.373 . . . . 0.0 110.241 -176.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -65.52 -52.5 52.17 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.368 177.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.584 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.4 tt -62.57 -39.58 85.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.5 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 84.3 tttt -58.16 -43.16 87.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.12 176.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.565 ' HA ' HG22 ' A' ' 123' ' ' VAL . 27.0 t70 -63.56 -37.48 87.47 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 121.233 0.539 . . . . 0.0 110.181 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -66.14 -33.06 74.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.829 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 84.0 mt -68.72 -47.73 65.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.355 177.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.565 HG22 ' HA ' ' A' ' 120' ' ' ASP . 18.9 m -73.58 -8.67 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.2 -178.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 32.1 t -65.32 -0.12 1.68 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.954 171.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.652 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.7 mp0 -101.59 85.94 2.85 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -178.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -55.71 -28.96 58.49 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.492 -175.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.513 ' O ' ' SG ' ' A' ' 128' ' ' CYS . 71.3 mtt85 -61.7 -46.25 90.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.717 0.294 . . . . 0.0 111.18 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 127' ' ' ARG . 97.7 m -168.2 123.47 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -177.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.499 ' HB1' ' HA ' ' A' ' 123' ' ' VAL . . . -164.22 93.64 0.7 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.053 0.454 . . . . 0.0 111.526 -177.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.476 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 40.5 mt-10 -127.04 150.01 49.65 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 172.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.2 p -155.43 142.24 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.855 0.36 . . . . 0.0 111.348 -176.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 41.5 p -126.71 138.19 53.36 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 174.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.648 ' HG ' ' HG2' ' A' ' 64' ' ' MET . 6.0 mp -97.68 172.24 7.83 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.569 -0.16 . . . . 0.0 110.569 -175.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -56.34 86.78 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -177.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 63.01 -79.29 0.03 OUTLIER Glycine 0 CA--C 1.521 0.418 0 N-CA-C 114.786 0.675 . . . . 0.0 114.786 169.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -65.77 123.18 19.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.006 0.432 . . . . 0.0 111.973 -170.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.425 ' CE ' ' HA ' ' A' ' 137' ' ' MET . 5.0 mmt -80.5 105.19 11.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.718 174.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.429 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 4.8 m-85 -67.05 -53.15 27.05 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.553 -175.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.429 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 58.8 Cg_endo -70.82 103.74 1.38 Allowed 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.881 1.721 . . . . 0.0 112.612 -177.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 63.71 -114.5 6.91 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.808 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 86.5 tttt . . . . . 0 C--O 1.237 0.419 0 CA-C-O 120.88 0.372 . . . . 0.0 110.479 179.853 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.624 0 N-CA-C 111.876 -0.49 . . . . 0.0 111.876 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -114.66 168.03 10.23 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.444 ' O ' HG12 ' A' ' 3' ' ' ILE . 13.6 tt -137.8 23.1 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.547 0.689 . . . . 0.0 110.279 -176.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.516 ' HA ' HD22 ' A' ' 7' ' ' ASN . 49.6 ttt180 -56.02 -35.22 66.61 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.418 -177.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -51.23 -43.88 61.55 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.299 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.452 ' CZ ' ' HA3' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -62.36 -42.21 99.22 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 177.883 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.531 ' O ' ' HB2' ' A' ' 11' ' ' MET . 49.0 m-80 -58.87 -66.4 0.51 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.865 -177.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -51.79 -60.82 2.73 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.454 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.571 ' HA ' ' NH1' ' A' ' 13' ' ' ARG . . . -56.08 -70.95 0.1 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.58 -176.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 6' ' ' TYR . 2.7 m-20 -60.9 -56.83 16.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.452 -174.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.531 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 10.8 mmt -60.84 -49.63 76.72 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.974 -0.29 . . . . 0.0 111.18 -172.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.483 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -64.14 -44.78 91.14 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.582 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.571 ' NH1' ' HA ' ' A' ' 9' ' ' ALA . 54.5 mtt85 -85.78 -1.95 57.74 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 17' ' ' GLN . 55.9 tp -95.56 -46.68 6.55 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 171.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.643 HD12 ' SD ' ' A' ' 63' ' ' MET . 3.8 mm? -76.0 -20.96 57.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.373 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 31.3 tp10 -48.61 -40.54 27.88 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.776 0.798 . . . . 0.0 109.019 170.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.47 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 7.9 tt0 -60.26 -58.85 6.74 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 114.304 -1.317 . . . . 0.0 110.336 175.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 47.9 m95 -53.06 -38.45 62.48 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.682 -177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 15' ' ' LEU . 43.3 mt-10 -67.52 -44.31 78.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.148 178.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.471 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.1 tttt -60.16 -50.0 75.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.158 177.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -58.03 -36.87 73.34 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 178.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.63 -50.48 72.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.411 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -62.73 -38.31 89.99 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.052 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.2 mt -63.02 -41.12 91.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 120.833 0.349 . . . . 0.0 110.546 178.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -74.44 -23.03 58.86 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.18 0.514 . . . . 0.0 109.883 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -72.19 -17.09 61.96 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 121.556 0.693 . . . . 0.0 109.368 171.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.48 21.29 35.05 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.898 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -132.43 115.83 16.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--N 1.33 -0.274 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.425 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.637 HD11 ' HE3' ' A' ' 64' ' ' MET . 3.3 tm? . . . . . 0 C--O 1.235 0.325 0 CA-C-O 121.307 0.575 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.643 ' SD ' HD12 ' A' ' 15' ' ' LEU . 21.6 ptt? -147.28 131.55 17.47 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.107 167.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.637 ' HE3' HD11 ' A' ' 62' ' ' LEU . 58.9 mtt -118.42 138.43 52.46 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.7 -170.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -103.83 114.31 28.47 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 168.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.563 HG21 HD13 ' A' ' 122' ' ' LEU . 21.6 t -114.39 112.03 38.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 118.007 0.367 . . . . 0.0 110.959 -172.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.659 HG23 ' HB2' ' A' ' 130' ' ' GLU . 7.9 t -98.16 123.81 42.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 175.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.06 -60.59 2.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.21 -174.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.7 t -92.8 -57.46 2.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.339 -172.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.72 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 91.25 29.64 12.16 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -168.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.673 ' HB3' ' HG3' ' A' ' 76' ' ' GLU . 10.3 t30 -125.19 132.77 24.39 Favored Pre-proline 0 CA--C 1.536 0.424 0 C-N-CA 122.858 0.463 . . . . 0.0 110.325 -178.364 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.4 -17.11 34.9 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.381 2.721 . . . . 0.0 114.406 -173.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.45 ' H ' ' ND2' ' A' ' 71' ' ' ASN . 4.7 m -81.47 139.37 35.23 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 112.069 -175.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -41.44 -49.24 3.9 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.631 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -39.1 -41.8 0.85 Allowed 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.773 0.671 . . . . 0.0 112.495 -167.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.673 ' HG3' ' HB3' ' A' ' 71' ' ' ASN . 9.8 mm-40 -59.74 -70.47 0.16 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.273 -174.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.455 HG21 ' HA ' ' A' ' 102' ' ' SER . 15.2 t -61.73 -38.64 88.67 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.859 0.361 . . . . 0.0 110.648 -178.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -53.67 -62.65 1.52 Allowed 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.612 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.443 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 51.9 mt-10 -71.41 -38.69 71.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.816 -173.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.48 HD12 HD12 ' A' ' 83' ' ' LEU . 10.6 tp -66.48 -39.94 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.395 -178.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 90.2 m -69.02 -34.54 75.42 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 58.5 m -57.44 -45.21 84.94 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.109 174.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.48 HD12 HD12 ' A' ' 80' ' ' ILE . 83.6 mt -61.13 -51.86 67.29 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.225 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.4 m0 -62.25 -27.62 69.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.525 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.524 HE21 ' HB2' ' A' ' 89' ' ' PHE . 1.0 OUTLIER -72.19 -57.74 3.99 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 174.099 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -57.01 -12.72 7.53 Favored Glycine 0 CA--C 1.523 0.559 0 CA-C-N 115.693 -0.685 . . . . 0.0 113.672 176.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 24.4 m -95.92 -67.98 0.82 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 117.084 0.442 . . . . 0.0 110.862 174.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.5 mp -66.34 -56.45 11.05 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.713 -172.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.524 ' HB2' HE21 ' A' ' 85' ' ' GLN . 65.0 m-85 -66.13 -26.45 67.45 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.176 -176.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -72.16 -30.29 64.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.194 0.521 . . . . 0.0 109.657 175.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.0 5.9 24.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.542 175.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 76.32 17.8 1.95 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.333 176.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -78.79 91.87 4.77 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -82.79 71.96 9.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.55 0.69 . . . . 0.0 109.967 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.412 HG12 HD21 ' A' ' 109' ' ' LEU . 5.6 m -88.14 178.13 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.421 178.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.583 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 4.9 tp60 -109.95 142.1 41.8 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 119.731 -0.787 . . . . 0.0 109.759 171.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.414 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -150.06 134.94 17.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.083 -178.01 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.438 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 29.5 m-85 -116.87 134.57 54.61 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 175.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 tt -100.02 90.56 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.827 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -137.39 137.02 46.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.425 -0.807 . . . . 0.0 108.97 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.452 ' HA3' ' CZ ' ' A' ' 6' ' ' TYR . . . 75.26 101.97 0.11 Allowed Glycine 0 C--O 1.225 -0.433 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 -169.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.455 ' HA ' HG21 ' A' ' 77' ' ' THR . 15.2 m -60.31 -10.08 4.27 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.72 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 4.1 p-10 -100.46 -4.85 28.03 Favored 'General case' 0 C--O 1.239 0.517 0 O-C-N 121.974 -0.454 . . . . 0.0 111.179 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 75.4 mtt180 -131.89 151.94 51.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.524 0.678 . . . . 0.0 111.831 -173.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.57 136.17 51.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.209 166.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.502 ' CD1' HD21 ' A' ' 15' ' ' LEU . 4.7 tt -112.46 128.99 68.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.429 . . . . 0.0 110.809 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -118.02 145.94 44.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.967 -179.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.583 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -141.61 147.62 37.92 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-O 121.472 0.654 . . . . 0.0 110.837 175.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.412 HD21 HG12 ' A' ' 95' ' ' VAL . 89.6 mt -131.93 136.02 47.05 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.893 -177.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -92.47 -31.2 15.35 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 164.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.14 110.22 22.21 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.942 -1.026 . . . . 0.0 108.361 170.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -113.45 13.42 23.17 Favored Glycine 0 C--N 1.329 0.143 0 C-N-CA 121.056 -0.592 . . . . 0.0 113.303 -173.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.4 t -61.55 -20.17 62.97 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.757 0.313 . . . . 0.0 111.366 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -118.68 19.02 13.32 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.97 0.414 . . . . 0.0 110.862 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.492 ' HB1' ' HG ' ' A' ' 62' ' ' LEU . . . -62.03 -44.93 95.65 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.01 -176.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -65.19 -33.88 77.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.893 -174.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -61.16 -46.69 89.49 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.191 0.52 . . . . 0.0 109.745 177.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 1.7 mp -62.04 -42.28 94.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.828 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -52.99 -53.56 48.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.114 0.483 . . . . 0.0 110.181 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.442 ' HA ' HG22 ' A' ' 123' ' ' VAL . 0.8 OUTLIER -60.35 -36.44 77.99 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.035 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -65.19 -48.55 73.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 0.0 110.046 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.563 HD13 HG21 ' A' ' 66' ' ' VAL . 88.3 mt -53.6 -47.07 70.53 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.459 177.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 120' ' ' ASP . 21.3 m -79.5 -13.74 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.363 -178.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 36.9 t -74.56 2.28 10.08 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.857 0.361 . . . . 0.0 111.457 175.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -78.26 164.81 24.57 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.019 0.438 . . . . 0.0 111.586 -176.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.9 -63.66 1.07 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 115.182 -0.917 . . . . 0.0 111.04 -172.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -75.16 -5.28 43.52 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.216 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 45.7 t 61.42 104.41 0.02 OUTLIER 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.318 0.58 . . . . 0.0 109.79 -173.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -71.62 133.14 45.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.845 -177.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.659 ' HB2' HG23 ' A' ' 67' ' ' THR . 50.3 mm-40 -83.35 113.25 20.6 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 176.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.481 HG23 HG22 ' A' ' 66' ' ' VAL . 7.5 p -109.7 134.22 52.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.851 -175.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 22.9 p -122.37 143.24 49.78 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 31.6 mt -107.67 135.23 49.45 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -175.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -96.63 141.39 29.93 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.94 -127.52 9.22 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.955 -0.458 . . . . 0.0 111.955 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -135.2 145.0 47.27 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -179.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 84.7 mtp -73.71 116.1 13.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.535 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.58 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 49.7 p90 -73.27 -31.26 1.38 Allowed Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 176.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 65.2 Cg_endo -73.02 101.96 1.39 Allowed 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 121.256 1.304 . . . . 0.0 111.495 173.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 115.61 -107.53 1.73 Allowed Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.684 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 95.7 mttt . . . . . 0 C--O 1.235 0.309 0 CA-C-O 120.685 0.278 . . . . 0.0 110.553 -178.128 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.703 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -171.83 -58.93 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.073 0.463 . . . . 0.0 110.609 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.614 HG12 ' HD2' ' A' ' 6' ' ' TYR . 12.8 tt -110.95 4.96 8.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.09 -173.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.567 ' HA ' ' OD1' ' A' ' 7' ' ' ASN . 99.2 mtt180 -58.72 -13.52 6.21 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -177.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.47 -49.84 71.44 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.519 177.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.614 ' HD2' HG12 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -69.68 -37.61 76.71 Favored 'General case' 0 C--N 1.338 0.065 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.626 -178.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 4' ' ' ARG . 14.7 m120 -48.9 -69.24 0.12 Allowed 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 176.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.24 -68.12 0.22 Allowed 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.047 -177.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.34 -59.97 4.45 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.665 -171.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.452 ' HB3' ' O ' ' A' ' 6' ' ' TYR . 23.5 t70 -66.91 -48.17 69.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.741 -170.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.55 ' HB2' ' O ' ' A' ' 7' ' ' ASN . 6.0 mmt -69.98 -47.07 63.74 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.974 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.42 81.91 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.97 0.414 . . . . 0.0 110.764 -178.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -68.87 -19.51 64.24 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.167 -178.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.18 -52.52 16.17 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 169.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.44 HD23 ' O ' ' A' ' 11' ' ' MET . 4.4 mm? -69.91 -15.08 63.01 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.808 -176.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -48.41 -55.49 10.7 Favored 'General case' 0 C--O 1.247 0.95 0 CA-C-O 121.533 0.682 . . . . 0.0 111.055 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -66.09 -29.59 69.95 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.53 -178.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.465 ' CH2' ' SD ' ' A' ' 108' ' ' MET . 45.2 m95 -64.05 -41.66 97.31 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -57.91 -47.91 81.45 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.51 ' O ' HG13 ' A' ' 24' ' ' ILE . 83.7 tttt -57.23 -40.71 78.11 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.04 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -62.17 -51.64 67.03 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.727 0.299 . . . . 0.0 110.948 -175.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.67 -25.48 60.28 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.745 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 -39.67 85.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.767 0.318 . . . . 0.0 110.16 171.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 20' ' ' LYS . 74.2 mt -62.5 -37.82 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -65.58 -34.95 79.44 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.922 175.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -71.37 -20.28 62.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.362 0.601 . . . . 0.0 109.68 174.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.05 35.05 7.28 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.796 176.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -143.82 132.13 22.01 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 176.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.4 mm? . . . . . 0 C--O 1.238 0.459 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.415 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.453 HD13 ' HA3' ' A' ' 112' ' ' GLY . 3.0 tt . . . . . 0 C--O 1.235 0.312 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.522 ' HG3' ' HB2' ' A' ' 134' ' ' GLU . 22.7 ptp -126.41 124.54 40.41 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.155 -179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.458 ' HG2' ' CD2' ' A' ' 133' ' ' LEU . 55.6 mtt -107.68 118.03 35.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.466 -176.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.453 ' CZ ' HD12 ' A' ' 106' ' ' ILE . 9.5 m-85 -100.49 126.55 46.92 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 173.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.413 HG11 ' CH2' ' A' ' 84' ' ' TRP . 25.8 t -113.01 100.72 11.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.856 0.36 . . . . 0.0 110.303 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.649 ' HB ' ' HB2' ' A' ' 130' ' ' GLU . 34.5 m -74.31 99.01 3.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.719 175.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.597 HG11 HG21 ' A' ' 80' ' ' ILE . 58.5 t -96.4 -55.94 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.195 0.521 . . . . 0.0 110.634 -175.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.419 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 9.7 m -87.36 -63.3 1.33 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.483 -172.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 82.1 -10.62 52.68 Favored Glycine 0 CA--C 1.518 0.263 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 -169.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.608 HD21 HG23 ' A' ' 73' ' ' THR . 10.1 t30 -126.52 137.53 30.57 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -55.6 -17.21 16.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.876 3.051 . . . . 0.0 115.261 -171.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.608 HG23 HD21 ' A' ' 71' ' ' ASN . 9.8 p -49.78 100.02 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -176.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.46 ' HG3' ' H ' ' A' ' 74' ' ' GLU . 11.9 mt-10 -31.95 -44.94 0.09 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.928 1.291 . . . . 0.0 113.247 175.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.883 ' H ' ' HD2' ' A' ' 75' ' ' LYS . 3.1 mptp? -51.58 -48.47 63.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.342 -166.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.419 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 14.7 mm-40 -58.66 -56.71 18.68 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.204 -174.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.481 HG21 ' HA ' ' A' ' 102' ' ' SER . 14.6 t -64.59 -37.13 86.5 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.559 -176.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.91 -55.25 37.3 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.478 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 54.0 mt-10 -58.77 -55.44 35.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.769 -178.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.597 HG21 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -63.26 -47.4 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.499 -172.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.481 HG21 ' HB ' ' A' ' 99' ' ' ILE . 45.0 m -68.88 -31.67 70.77 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.206 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 18.9 t -68.82 -41.23 78.9 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 79' ' ' GLU . 98.6 mt -61.21 -46.47 90.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 175.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.765 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 40.8 m0 -61.65 -36.58 81.19 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.841 177.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -59.52 -65.95 0.59 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.778 -0.452 . . . . 0.0 109.778 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -51.39 -28.73 21.28 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.325 178.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.8 m -87.82 -61.76 1.65 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 117.641 0.721 . . . . 0.0 111.923 -178.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.1 -53.68 46.72 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.261 0.553 . . . . 0.0 111.248 -176.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -76.76 -10.81 59.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.533 -171.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -84.92 -33.19 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 172.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.21 2.21 28.78 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.187 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 74.12 20.15 2.8 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.707 175.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -82.86 71.19 9.96 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 171.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.26 82.27 3.74 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.466 0.651 . . . . 0.0 110.665 -176.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.4 m -87.76 175.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.023 174.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.504 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 5.6 tp60 -99.77 120.68 40.12 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.696 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -119.72 125.89 49.75 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.719 -164.526 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -128.38 113.15 15.21 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.481 ' HB ' HG21 ' A' ' 81' ' ' THR . 6.0 tt -100.27 90.19 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.635 0.731 . . . . 0.0 109.505 175.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -132.76 125.01 51.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.498 -178.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 75.01 102.01 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.147 -0.781 . . . . 0.0 111.147 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.481 ' HA ' HG21 ' A' ' 77' ' ' THR . 21.9 m -47.47 -22.14 0.42 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.453 ' HB2' HG21 ' A' ' 3' ' ' ILE . 17.4 t70 -54.34 -60.49 3.28 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.311 177.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -130.02 136.64 49.62 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.074 0.464 . . . . 0.0 111.688 -174.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -107.69 130.61 54.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 172.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.453 HD12 ' CZ ' ' A' ' 65' ' ' PHE . 7.8 tt -109.27 129.46 63.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-O 121.255 0.55 . . . . 0.0 112.267 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -112.7 122.21 47.01 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.188 172.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.465 ' SD ' ' CH2' ' A' ' 18' ' ' TRP . 61.1 mtt -101.16 133.09 46.23 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -110.62 131.65 54.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.653 -176.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -77.5 -46.68 21.7 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 169.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -134.49 131.24 37.8 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.167 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . 0.453 ' HA3' HD13 ' A' ' 62' ' ' LEU . . . -120.26 56.95 0.59 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.99 -173.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.5 m -63.93 -51.17 65.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.284 0.564 . . . . 0.0 109.571 175.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -83.44 29.69 0.5 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.451 177.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -57.64 -49.14 77.44 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.943 0.402 . . . . 0.0 111.706 -177.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -74.7 -23.7 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.951 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -68.43 -52.66 30.22 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.987 0.422 . . . . 0.0 109.895 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.609 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.0 tt -64.85 -40.92 90.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.279 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -58.61 -44.5 89.94 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.92 0.391 . . . . 0.0 110.119 177.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.35 -43.79 83.75 Favored 'General case' 0 C--O 1.239 0.553 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.92 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -63.54 -36.58 84.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.105 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.6 mt -66.31 -45.37 80.56 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.906 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.9 m -78.52 -12.1 13.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.367 -178.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 16.3 t -62.6 2.13 0.31 Allowed 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 176.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.765 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 2.8 mp0 -106.85 131.72 53.63 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 122.08 -0.387 . . . . 0.0 111.568 -175.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -66.22 -18.07 65.12 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.909 170.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 24.2 mmm180 -58.5 -13.61 5.98 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.565 174.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 127' ' ' ARG . 49.5 t 78.25 143.7 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.891 0.744 . . . . 0.0 110.824 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -166.19 99.02 0.62 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.79 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.649 ' HB2' ' HB ' ' A' ' 67' ' ' THR . 5.9 mm-40 -83.34 111.83 19.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 174.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 50.1 t -98.2 121.92 49.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.262 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 p -132.02 122.08 24.93 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.738 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.458 ' CD2' ' HG2' ' A' ' 64' ' ' MET . 21.8 mt -87.56 127.67 35.26 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -178.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.522 ' HB2' ' HG3' ' A' ' 63' ' ' MET . 39.9 mm-40 -90.88 102.62 15.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.265 0.555 . . . . 0.0 110.096 176.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 151.98 -178.57 29.16 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.982 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -73.0 99.02 2.63 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 -179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 84.2 mtp -70.23 99.29 1.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.441 -178.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.479 ' CG ' ' HD3' ' A' ' 139' ' ' PRO . 26.7 p90 -61.03 -29.21 5.07 Favored Pre-proline 0 CA--C 1.548 0.895 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 178.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.479 ' HD3' ' CG ' ' A' ' 138' ' ' TYR . 31.4 Cg_exo -63.39 -7.22 11.77 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 121.773 1.649 . . . . 0.0 112.688 172.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -149.14 -97.11 0.17 Allowed Glycine 0 C--N 1.333 0.376 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 98.4 mttt . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 120.866 0.365 . . . . 0.0 110.421 177.541 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.996 0 N-CA-C 112.227 -0.349 . . . . 0.0 112.227 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -120.66 157.32 29.84 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 122.358 0.263 . . . . 0.0 110.303 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.1 tt -113.22 -13.21 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-O 120.919 0.39 . . . . 0.0 111.22 -176.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -58.51 -34.04 70.51 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -174.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -51.33 -50.87 58.61 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.276 0.56 . . . . 0.0 110.092 178.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -48.28 82.39 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.16 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 11' ' ' MET . 30.1 m-80 -51.73 -66.77 0.33 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.397 -176.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -53.59 -59.8 4.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.01 -64.76 0.84 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.945 0.403 . . . . 0.0 111.703 -173.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -64.95 -48.88 72.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.315 -171.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' ' HE1' ' A' ' 65' ' ' PHE . 4.3 mmt -65.19 -44.72 87.49 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.897 -175.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.65 -51.07 66.78 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.802 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -62.59 -31.86 72.76 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.63 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.0 tp -76.41 -53.26 8.39 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.844 0.354 . . . . 0.0 111.181 177.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.652 HD12 ' SD ' ' A' ' 63' ' ' MET . 4.3 mm? -68.79 -17.41 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.046 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -60.11 -35.19 74.7 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.013 0.435 . . . . 0.0 109.873 174.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -62.42 -50.04 73.09 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.59 ' HH2' ' HG2' ' A' ' 96' ' ' GLN . 33.3 m95 -54.38 -42.71 70.68 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.797 -178.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -56.57 -54.44 45.86 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 173.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.616 ' O ' HG13 ' A' ' 24' ' ' ILE . 77.5 tttt -56.73 -35.65 68.81 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.358 -178.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -64.01 -55.66 20.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.81 0.338 . . . . 0.0 111.136 -178.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -74.28 -22.52 59.26 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.629 . . . . 0.0 110.572 -175.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.517 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 27.6 m-20 -75.59 -28.45 58.93 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 172.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.616 HG13 ' O ' ' A' ' 20' ' ' LYS . 63.6 mt -68.2 -32.62 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -65.58 -35.85 82.03 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.718 172.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.517 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 31.5 mm-40 -55.83 -16.83 5.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.006 0.431 . . . . 0.0 110.683 169.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.05 14.15 55.14 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.782 -0.645 . . . . 0.0 114.001 171.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -138.55 146.54 42.01 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.43 HD13 HG12 ' A' ' 24' ' ' ILE . 3.3 mm? . . . . . 0 C--O 1.236 0.375 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.819 -176.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.1 mt . . . . . 0 C--O 1.237 0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.652 ' SD ' HD12 ' A' ' 15' ' ' LEU . 44.9 mtm -140.09 110.23 6.54 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 174.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.656 ' HG2' HD23 ' A' ' 133' ' ' LEU . 63.0 mtt -110.3 133.04 53.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.401 -171.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.595 ' HE1' ' SD ' ' A' ' 11' ' ' MET . 68.0 m-85 -95.28 134.36 38.14 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 168.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 20.7 t -126.62 106.95 16.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.486 HG23 ' HB2' ' A' ' 130' ' ' GLU . 3.0 t -91.44 110.69 22.0 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.7 t -102.15 -60.86 2.65 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.068 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 76' ' ' GLU . 10.8 m -71.76 -44.6 63.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.705 -173.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.678 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 69.08 2.96 34.38 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.238 -0.506 . . . . 0.0 111.852 -172.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.515 ' OD1' ' HD2' ' A' ' 72' ' ' PRO . 53.3 t30 -126.25 132.26 24.25 Favored Pre-proline 0 CA--C 1.532 0.263 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.516 ' O ' ' HB3' ' A' ' 102' ' ' SER . 10.4 Cg_endo -50.79 -16.52 2.45 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 123.556 2.837 . . . . 0.0 113.941 -179.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.8 p -64.74 90.96 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.988 0.423 . . . . 0.0 110.615 176.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -53.76 -30.57 45.03 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.015 -177.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -40.4 -46.35 2.38 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.469 0.708 . . . . 0.0 112.515 -178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.437 ' HB2' ' OG ' ' A' ' 69' ' ' SER . 60.8 mm-40 -63.28 -49.95 72.04 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.455 -177.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.478 ' HA ' HG22 ' A' ' 80' ' ' ILE . 91.8 m -62.82 -34.78 78.03 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.763 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.96 -51.87 67.43 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.501 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -64.39 -47.21 80.06 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.293 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.542 HD12 HD12 ' A' ' 83' ' ' LEU . 10.9 tp -65.28 -41.78 92.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.029 -0.269 . . . . 0.0 110.927 -177.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 94.0 m -64.73 -34.05 77.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 120.935 0.398 . . . . 0.0 110.409 177.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 32.2 t -60.39 -44.48 95.63 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.542 HD12 HD12 ' A' ' 80' ' ' ILE . 84.2 mt -59.01 -44.42 91.69 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.018 175.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.611 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 52.5 m0 -56.64 -38.88 72.75 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.752 179.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -63.96 -56.34 15.87 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.72 -15.65 13.51 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.624 -0.717 . . . . 0.0 114.02 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.3 m -96.37 -65.24 0.98 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 117.574 0.687 . . . . 0.0 111.337 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.38 -51.57 68.94 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.353 -175.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -72.77 -20.16 61.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -67.54 -36.2 80.53 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 172.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.8 1.72 48.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.408 175.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 67.7 31.53 5.93 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.408 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -77.76 100.74 6.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.159 174.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -77.38 89.66 3.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.404 0.621 . . . . 0.0 110.617 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.1 m -119.52 157.32 21.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.241 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.59 ' HG2' ' HH2' ' A' ' 18' ' ' TRP . 6.8 tp60 -101.92 103.92 14.6 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.561 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -107.94 135.79 48.73 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.919 -177.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.404 ' HB2' ' CG2' ' A' ' 106' ' ' ILE . 17.4 m-85 -120.71 121.28 37.92 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.0 tt -92.18 88.5 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 122.139 0.971 . . . . 0.0 109.268 174.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.3 p -145.28 134.28 17.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 177.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 99.9 103.06 2.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -166.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.516 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 16.4 m -37.3 -51.32 1.06 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -171.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.678 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 6.2 p-10 -101.05 -4.78 26.76 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 120.795 0.331 . . . . 0.0 111.441 -177.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.6 tpp85 -113.44 126.18 55.05 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.33 -168.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -115.24 130.77 57.0 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 170.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.46 HG12 ' SD ' ' A' ' 108' ' ' MET . 10.9 tt -108.74 146.43 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.832 0.349 . . . . 0.0 111.445 -178.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -132.65 126.96 33.84 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.908 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.481 ' HG3' ' HG2' ' A' ' 63' ' ' MET . 3.6 mpp? -115.35 122.58 46.31 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 174.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.432 ' N ' HD12 ' A' ' 109' ' ' LEU . 5.7 mp -109.14 139.63 43.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.566 -178.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 21.4 mmt180 -104.2 5.93 35.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.27 0.557 . . . . 0.0 109.782 174.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -137.45 146.73 44.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.388 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -125.01 20.66 6.68 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.36 -174.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.6 m -76.74 -46.38 25.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.411 0.624 . . . . 0.0 110.127 179.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.1 p90 -105.48 22.44 15.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.076 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.29 -49.15 78.75 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.163 0.506 . . . . 0.0 111.611 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -23.83 56.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.115 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -72.33 -45.21 60.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.643 178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 10.4 tt -66.26 -39.89 85.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -57.6 -41.01 80.36 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.122 0.487 . . . . 0.0 109.981 173.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.471 ' HA ' HG22 ' A' ' 123' ' ' VAL . 31.2 t70 -63.54 -41.15 98.47 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.587 178.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -62.51 -36.4 82.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.064 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 92.7 mt -66.43 -49.73 65.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.863 178.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.471 HG22 ' HA ' ' A' ' 120' ' ' ASP . 19.3 m -72.05 -13.44 16.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 CA-C-O 120.932 0.396 . . . . 0.0 110.905 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 25.2 t -69.85 2.2 3.64 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.708 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.611 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 73.6 mt-30 -88.23 92.31 9.11 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.394 0.616 . . . . 0.0 110.192 -178.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -49.28 -40.96 36.55 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.72 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.45 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 98.1 mtt180 -56.6 -48.23 77.88 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 127' ' ' ARG . 51.3 t 165.8 138.12 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.461 0.475 . . . . 0.0 110.191 -174.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 179.54 110.69 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.495 0.497 . . . . 0.0 110.935 175.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . 0.486 ' HB2' HG23 ' A' ' 67' ' ' THR . 35.9 mt-10 -108.02 116.76 32.55 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 172.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.54 138.25 39.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.871 176.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.5 m -149.31 153.54 37.64 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.656 HD23 ' HG2' ' A' ' 64' ' ' MET . 70.7 mt -85.92 156.02 20.68 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.647 0.26 . . . . 0.0 110.465 -179.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.586 ' HG2' ' CE2' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -72.38 148.54 45.16 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 175.375 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 77.08 -81.71 1.16 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.238 -0.506 . . . . 0.0 112.791 176.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -141.83 143.8 33.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.944 0.402 . . . . 0.0 110.879 -176.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . 0.582 ' HG3' ' HD2' ' A' ' 139' ' ' PRO . 14.0 tpt -90.53 115.99 28.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.382 177.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.648 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 98.9 m-85 -56.15 -52.77 70.12 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.648 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 32.5 Cg_exo -58.45 94.72 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.005 1.803 . . . . 0.0 111.982 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 99.94 26.44 8.44 Favored Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.488 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 84.0 tttt . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 120.685 0.279 . . . . 0.0 110.739 177.143 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.827 0 N-CA-C 112.106 -0.398 . . . . 0.0 112.106 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -127.35 -174.79 3.26 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 110.422 177.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.611 HG12 ' HB3' ' A' ' 6' ' ' TYR . 14.0 tt -107.02 23.5 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.95 0.881 . . . . 0.0 109.414 177.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -65.97 -16.89 64.29 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.426 -174.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -57.39 -46.34 83.54 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.611 ' HB3' HG12 ' A' ' 3' ' ' ILE . 0.7 OUTLIER -62.6 -47.13 85.15 Favored 'General case' 0 C--O 1.226 -0.154 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.025 174.75 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.433 HD22 ' N ' ' A' ' 7' ' ' ASN . 0.9 OUTLIER -54.0 -68.05 0.21 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -178.4 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -50.02 -64.59 0.76 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.255 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 13' ' ' ARG . . . -57.56 -62.53 1.72 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.277 -172.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.534 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 16.6 t70 -64.09 -63.39 1.17 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.56 -174.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 14.0 mmt -54.75 -55.75 26.57 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.815 0.34 . . . . 0.0 110.846 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.09 -53.78 10.2 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.3 -173.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.426 ' HB2' ' O ' ' A' ' 9' ' ' ALA . 35.5 mtt180 -80.13 -8.2 59.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.746 -167.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.534 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 52.5 tp -98.96 -52.98 3.4 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 171.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 11' ' ' MET . 3.9 mm? -71.26 -11.4 60.9 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.584 0.23 . . . . 0.0 111.358 -175.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -48.47 -48.94 37.42 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.18 171.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 11.3 pt20 -57.43 -38.16 73.95 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.382 -175.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -64.63 -39.22 93.32 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.948 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.77 -47.38 85.93 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 24' ' ' ILE . 5.3 ttpm? -63.32 -33.28 75.17 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.214 -179.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -63.67 -48.37 77.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 109.946 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.77 -37.82 71.62 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.672 175.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 26' ' ' GLU . 72.7 m-20 -68.43 -40.33 81.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.407 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.568 HG13 ' O ' ' A' ' 20' ' ' LYS . 77.8 mt -62.51 -38.37 81.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 CA-C-O 121.363 0.601 . . . . 0.0 109.662 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -70.91 -28.69 64.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.237 175.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 23' ' ' ASP . 10.0 tp10 -64.29 -12.07 38.05 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.127 172.047 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.13 21.87 34.27 Favored Glycine 0 C--N 1.333 0.381 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.687 173.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -152.03 153.06 33.24 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.184 0.516 . . . . 0.0 111.469 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.168 175.213 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 133' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.418 0 CA-C-O 121.416 0.627 . . . . 0.0 112.468 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.589 ' HB2' ' HB3' ' A' ' 134' ' ' GLU . 35.3 mtp -126.74 148.67 49.87 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 166.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.54 ' HE1' ' O ' ' A' ' 115' ' ' ALA . 62.4 mtt -130.79 118.79 21.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.909 0.385 . . . . 0.0 111.583 -175.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.469 ' HB2' ' OG1' ' A' ' 132' ' ' THR . 25.1 m-85 -98.95 97.41 8.58 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 171.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.538 HG21 HD13 ' A' ' 122' ' ' LEU . 22.0 t -88.76 110.42 21.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.876 0.369 . . . . 0.0 111.466 -172.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.0 m -74.24 96.04 2.73 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.72 HG11 HG21 ' A' ' 80' ' ' ILE . 46.3 t -90.42 -48.46 14.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.314 0.578 . . . . 0.0 110.775 -174.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.836 ' HB3' ' HA ' ' A' ' 103' ' ' ASP . 43.7 t -90.97 -61.04 1.75 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.22 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 75.91 -3.2 52.09 Favored Glycine 0 CA--C 1.52 0.377 0 N-CA-C 111.061 -0.815 . . . . 0.0 111.061 -168.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -119.78 134.38 23.91 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 123.53 0.732 . . . . 0.0 109.695 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.16 -17.74 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.66 2.906 . . . . 0.0 114.832 -173.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.517 HG22 ' HD3' ' A' ' 75' ' ' LYS . 1.1 m -78.21 145.39 35.57 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.311 0.505 . . . . 0.0 110.343 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -85.27 -22.68 28.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -163.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.521 ' HD3' ' H ' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.06 -42.04 17.98 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.503 0.668 . . . . 0.0 110.706 -173.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -65.62 0.57 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.419 -175.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.417 HG21 ' HA ' ' A' ' 102' ' ' SER . 15.3 t -63.73 -37.13 86.19 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.784 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -60.24 -58.31 9.08 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.136 0.493 . . . . 0.0 110.524 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -60.69 -46.82 88.91 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.433 -177.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.72 HG21 HG11 ' A' ' 68' ' ' VAL . 10.4 tp -68.16 -40.18 82.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.931 -0.308 . . . . 0.0 111.406 -175.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 97.4 m -64.96 -35.96 82.87 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 27.1 t -62.22 -42.61 99.46 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.983 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.99 -49.02 79.14 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.194 0.521 . . . . 0.0 110.673 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.424 ' HZ3' ' HB3' ' A' ' 105' ' ' ALA . 43.4 m0 -61.16 -41.01 96.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.144 -179.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -55.49 -46.05 76.96 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.106 0.479 . . . . 0.0 109.881 172.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -68.5 -22.37 74.94 Favored Glycine 0 CA--C 1.518 0.277 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.747 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.3 m -96.28 -68.25 0.81 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.924 0.392 . . . . 0.0 111.858 -179.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.42 ' N ' HD12 ' A' ' 88' ' ' LEU . 7.3 mp -63.88 -45.89 87.36 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.85 -172.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -76.82 -0.39 23.78 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.769 0.318 . . . . 0.0 111.542 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -88.29 -36.09 16.87 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 171.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.28 -10.34 59.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.699 171.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 57.7 71.4 0.58 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.636 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -89.17 161.18 16.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.734 175.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -87.32 27.11 1.11 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.058 -177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.579 HG12 ' HG ' ' A' ' 109' ' ' LEU . 29.5 m -86.53 132.94 31.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.298 0.571 . . . . 0.0 111.219 -176.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -99.95 118.71 36.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 173.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.759 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.2 OUTLIER -127.13 140.86 51.96 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.832 -172.106 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -125.77 147.03 49.52 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.492 176.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.4 tt -112.76 98.36 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.538 0.685 . . . . 0.0 109.638 177.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.8 p -149.16 138.66 15.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.221 -0.899 . . . . 0.0 108.669 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 77.97 102.46 0.19 Allowed Glycine 0 C--O 1.226 -0.363 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.417 ' HA ' HG21 ' A' ' 77' ' ' THR . 14.0 m -49.32 -32.37 11.02 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -173.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.836 ' HA ' ' HB3' ' A' ' 69' ' ' SER . 10.3 p-10 -74.48 -16.81 60.84 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -177.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 53.9 mtt85 -134.44 156.4 48.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.88 0.848 . . . . 0.0 112.922 -169.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.424 ' HB3' ' HZ3' ' A' ' 84' ' ' TRP . . . -135.77 142.29 44.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.38 -1.282 . . . . 0.0 107.703 163.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 4.4 tt -117.15 137.39 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.54 -172.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -131.69 142.27 49.78 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.6 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.444 ' HG2' ' HE3' ' A' ' 63' ' ' MET . 70.6 mtp -127.51 119.65 26.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 177.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.579 ' HG ' HG12 ' A' ' 95' ' ' VAL . 5.0 mp -98.91 119.89 38.43 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.37 -32.65 58.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 175.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -112.64 111.55 22.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.355 -0.838 . . . . 0.0 109.593 169.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -85.3 22.94 8.99 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.309 -0.472 . . . . 0.0 112.642 -178.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -60.57 -49.06 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.993 0.425 . . . . 0.0 110.874 -179.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.405 ' O ' HG22 ' A' ' 118' ' ' ILE . 40.2 p90 -97.36 29.96 3.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.735 -178.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.54 ' O ' ' HE1' ' A' ' 64' ' ' MET . . . -56.12 -53.01 62.17 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.732 -178.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -75.54 -22.02 57.41 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.17 -177.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -68.3 -56.04 10.0 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 175.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.661 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 8.4 tt -59.47 -41.55 84.99 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.796 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.499 ' HB2' ' HE1' ' A' ' 64' ' ' MET . 65.7 tttm -55.06 -48.58 73.29 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.917 0.389 . . . . 0.0 110.337 177.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.04 -46.64 85.02 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.277 178.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -61.84 -41.29 97.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.47 -177.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 78.7 mt -61.58 -41.2 97.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.664 178.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 27.7 m -87.29 -4.83 9.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.575 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.3 m -70.48 2.4 4.0 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.51 0.324 . . . . 0.0 111.736 174.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.526 ' NE2' HG12 ' A' ' 80' ' ' ILE . 46.2 mt-30 -59.69 162.93 4.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.404 0.621 . . . . 0.0 111.777 -177.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -85.97 -42.76 13.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.091 -0.959 . . . . 0.0 108.789 176.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -71.04 -22.82 62.09 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.478 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 61.3 m 72.86 137.39 0.05 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.919 -177.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -137.72 156.08 48.39 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.542 -178.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -109.24 130.48 55.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.007 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.442 HG22 HG13 ' A' ' 66' ' ' VAL . 58.2 t -109.22 124.36 65.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.896 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.469 ' OG1' ' HB2' ' A' ' 65' ' ' PHE . 40.3 p -102.93 137.38 41.21 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 174.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 62' ' ' LEU . 50.1 mt -102.22 149.77 23.97 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.421 -172.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.589 ' HB3' ' HB2' ' A' ' 63' ' ' MET . 3.2 tm-20 -104.65 133.64 49.16 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 114.24 177.77 19.1 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -71.73 120.3 17.13 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 11.0 tpt -56.35 111.26 0.93 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.932 0.396 . . . . 0.0 110.671 -177.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.466 ' HB2' ' HD3' ' A' ' 139' ' ' PRO . 43.9 m-85 -74.27 -49.95 5.15 Favored Pre-proline 0 CA--C 1.538 0.516 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.485 -175.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.466 ' HD3' ' HB2' ' A' ' 138' ' ' TYR . 92.3 Cg_endo -78.53 171.29 17.02 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.811 1.674 . . . . 0.0 112.08 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -63.26 -56.0 22.69 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 121.148 -0.549 . . . . 0.0 112.208 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.234 0.263 0 C-N-CA 122.568 0.347 . . . . 0.0 110.184 178.32 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.916 0 N-CA-C 111.563 -0.615 . . . . 0.0 111.563 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.457 ' HB3' ' HG3' ' A' ' 4' ' ' ARG . 7.0 m-20 -114.01 152.44 30.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.138 0.494 . . . . 0.0 111.026 -176.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.46 ' O ' HG12 ' A' ' 3' ' ' ILE . 12.7 tt -119.15 11.32 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.887 -178.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.457 ' HG3' ' HB3' ' A' ' 2' ' ' ASP . 51.4 mtt180 -58.86 -49.72 76.68 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.93 -173.023 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -58.52 -42.69 88.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.469 -176.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.29 -48.83 80.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.077 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.621 ' HA ' ' SD ' ' A' ' 11' ' ' MET . 21.9 m-80 -60.38 -69.44 0.22 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.982 -179.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -49.53 -66.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.17 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.71 -60.37 3.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.914 -172.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -70.7 -44.54 66.72 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.155 0.502 . . . . 0.0 110.788 -169.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.621 ' SD ' ' HA ' ' A' ' 7' ' ' ASN . 71.0 mtp -74.51 -34.71 63.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.749 -172.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.54 -34.55 76.04 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.859 173.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 -62.8 -39.24 93.66 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.756 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.406 ' CD1' HD22 ' A' ' 15' ' ' LEU . 2.9 pp -84.05 -32.04 25.06 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.035 179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.426 HD23 ' O ' ' A' ' 11' ' ' MET . 3.5 mm? -69.28 -22.6 63.8 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.773 0.321 . . . . 0.0 110.273 174.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -48.8 -39.38 25.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.289 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -60.16 -46.32 90.07 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.347 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.484 ' CH2' ' HG3' ' A' ' 108' ' ' MET . 57.9 m95 -60.79 -42.14 96.98 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.179 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.06 -47.36 86.2 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.566 ' O ' HG13 ' A' ' 24' ' ' ILE . 87.5 tttt -62.99 -34.21 77.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.51 178.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.19 -54.22 48.45 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.453 0.168 . . . . 0.0 111.117 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.415 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 1.5 p-10 -70.65 -26.71 63.58 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.093 -178.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 11.5 m-20 -62.3 -48.43 79.91 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.071 0.462 . . . . 0.0 110.472 172.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.566 HG13 ' O ' ' A' ' 20' ' ' LYS . 80.7 mt -59.66 -40.39 82.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.753 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -67.53 -30.73 70.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.399 178.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 23' ' ' ASP . 74.3 mm-40 -60.43 -15.37 25.82 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 110.447 171.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.22 34.65 6.63 Favored Glycine 0 C--N 1.333 0.377 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.414 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -158.66 149.76 20.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.758 0.313 . . . . 0.0 110.247 173.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 29' ' ' LEU . 3.0 mm? . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.437 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' MET . . . . . 0.402 ' SD ' HD12 ' A' ' 15' ' ' LEU . 32.5 mtm -132.45 128.71 38.06 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 169.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 60.2 mtt -110.48 122.43 47.7 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.929 0.395 . . . . 0.0 112.049 -171.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -95.62 106.68 18.8 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 169.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.407 HG21 HD13 ' A' ' 122' ' ' LEU . 23.3 t -99.67 112.83 33.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.67 0.272 . . . . 0.0 110.768 -174.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.81 ' HA ' ' HG2' ' A' ' 104' ' ' ARG . 25.8 m -85.48 109.66 18.64 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.616 HG11 HG21 ' A' ' 80' ' ' ILE . 42.7 t -94.66 -62.97 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 111.641 -171.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 52.8 p -93.6 -48.06 6.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.201 -173.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 103' ' ' ASP . . . 77.66 9.24 87.01 Favored Glycine 0 N--CA 1.451 -0.336 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -165.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -126.22 129.22 24.27 Favored Pre-proline 0 CA--C 1.532 0.276 0 C-N-CA 123.618 0.767 . . . . 0.0 109.342 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.477 ' O ' ' HB3' ' A' ' 102' ' ' SER . 47.8 Cg_endo -65.64 -18.45 58.87 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.18 2.587 . . . . 0.0 114.816 -169.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.442 HG22 ' HG3' ' A' ' 75' ' ' LYS . 2.7 m -63.93 123.69 19.61 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.216 0.462 . . . . 0.0 110.944 -175.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -50.66 -29.04 10.13 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.759 0.824 . . . . 0.0 112.711 -175.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HG3' HG22 ' A' ' 73' ' ' THR . 25.2 mtpp -38.06 -60.74 0.72 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.447 0.699 . . . . 0.0 112.702 -176.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -59.98 -59.07 6.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.738 -171.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.6 t -60.65 -43.03 98.09 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 123.119 0.262 . . . . 0.0 110.999 -175.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.83 -61.91 2.26 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.957 0.408 . . . . 0.0 111.081 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.1 -50.22 74.22 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.053 -176.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.616 HG21 HG11 ' A' ' 68' ' ' VAL . 7.5 tp -64.45 -41.81 93.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.673 -173.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.0 m -66.34 -34.37 77.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.692 0.282 . . . . 0.0 110.652 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.501 ' O ' ' HB3' ' A' ' 85' ' ' GLN . 22.7 t -60.8 -43.45 98.14 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.331 0.586 . . . . 0.0 109.545 174.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.2 mt -64.29 -37.25 86.83 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.161 176.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . 0.586 ' HE1' ' NE2' ' A' ' 125' ' ' GLN . 46.3 m0 -67.11 -29.28 68.98 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.419 178.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.501 ' HB3' ' O ' ' A' ' 82' ' ' SER . 30.8 tt0 -62.51 -55.21 29.67 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -56.2 -26.95 51.31 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.429 -0.805 . . . . 0.0 113.432 175.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 26.3 m -86.87 -70.39 0.61 Allowed 'General case' 0 CA--C 1.536 0.441 0 O-C-N 122.387 -0.478 . . . . 0.0 111.411 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.6 mt -53.6 -50.2 66.14 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -173.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.44 ' CD2' ' HA ' ' A' ' 85' ' ' GLN . 57.0 m-85 -77.25 -24.15 51.17 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -170.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -82.38 -19.97 38.11 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 173.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.73 10.41 7.65 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.565 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 74.79 15.1 3.23 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.729 0.812 . . . . 0.0 112.486 174.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -89.79 153.88 20.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -149.19 77.44 1.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.579 0.704 . . . . 0.0 110.039 176.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 29.4 m -89.36 176.59 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.831 174.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.813 ' HB3' ' HG2' ' A' ' 108' ' ' MET . 5.8 tp60 -100.3 133.77 44.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 173.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.61 ' HD3' ' H ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -137.04 133.28 35.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.93 -164.524 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.417 ' O ' HG22 ' A' ' 106' ' ' ILE . 77.4 m-85 -137.85 132.66 32.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.341 176.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.9 tt -89.14 88.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.816 0.817 . . . . 0.0 109.298 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -136.96 137.9 46.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.777 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 89.96 102.09 1.13 Allowed Glycine 0 C--O 1.222 -0.618 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -166.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 72' ' ' PRO . 15.5 m -46.9 -36.11 7.2 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -171.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.444 ' HB2' ' H ' ' A' ' 70' ' ' GLY . 16.9 p-10 -101.18 9.84 41.48 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.81 ' HG2' ' HA ' ' A' ' 67' ' ' THR . 86.3 mtt85 -142.96 159.87 41.41 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.635 0.731 . . . . 0.0 112.34 -171.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.53 144.69 51.57 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.0 168.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.417 HG22 ' O ' ' A' ' 98' ' ' PHE . 13.2 tt -114.76 141.64 30.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.546 0 CA-C-O 120.999 0.428 . . . . 0.0 111.189 -177.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -135.21 106.87 6.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.165 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.813 ' HG2' ' HB3' ' A' ' 96' ' ' GLN . 0.3 OUTLIER -93.47 121.6 35.03 Favored 'General case' 0 C--O 1.243 0.752 0 CA-C-O 121.339 0.59 . . . . 0.0 110.118 176.12 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.443 ' N ' HD12 ' A' ' 109' ' ' LEU . 5.5 mp -105.45 120.98 42.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.153 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -54.66 15.61 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -112.51 111.4 22.2 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.42 174.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -86.27 56.6 4.77 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.249 -0.5 . . . . 0.0 113.183 -175.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.6 m -69.05 -29.38 67.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.868 0.366 . . . . 0.0 111.162 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -124.6 29.32 6.3 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.27 0.557 . . . . 0.0 110.905 -177.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.72 -43.11 90.02 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.716 -178.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.415 ' CH2' ' HG3' ' A' ' 139' ' ' PRO . 16.6 m95 -72.55 -34.43 67.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.724 -175.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.88 -51.29 65.27 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.506 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.554 ' O ' ' HG ' ' A' ' 122' ' ' LEU . 13.1 tt -63.09 -38.64 82.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 178.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 23.2 ttpp -53.04 -57.99 8.5 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.126 0.488 . . . . 0.0 110.623 176.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.691 ' HA ' HG22 ' A' ' 123' ' ' VAL . 33.2 m-20 -68.18 -26.56 65.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.211 -176.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -65.21 -43.07 92.71 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 118' ' ' ILE . 82.8 mt -72.69 -37.75 67.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.61 -178.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' HA ' ' A' ' 120' ' ' ASP . 14.1 m -73.37 -26.03 21.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.803 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 18.7 t -85.61 3.69 39.66 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.74 176.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.586 ' NE2' ' HE1' ' A' ' 84' ' ' TRP . 6.3 tp-100 -65.54 158.64 26.49 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.937 -170.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -60.7 -68.7 0.28 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.722 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -73.09 4.86 3.87 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.553 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 58.5 m 71.42 149.54 0.09 Allowed 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.317 0.647 . . . . 0.0 111.398 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.461 ' HA ' ' HA ' ' A' ' 68' ' ' VAL . . . -171.05 103.76 0.22 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.402 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -91.27 130.92 37.08 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.301 0.572 . . . . 0.0 110.515 -179.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 45.5 t -92.01 144.26 9.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.443 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 85.9 m -124.99 136.11 53.42 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 90.6 mt -96.51 125.87 41.3 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 110.573 -174.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -94.89 148.71 22.02 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.52 -115.66 5.27 Favored Glycine 0 N--CA 1.452 -0.268 0 N-CA-C 111.726 -0.55 . . . . 0.0 111.726 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -135.78 124.82 24.31 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 87.7 mtp -76.66 97.96 4.59 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.519 ' N ' ' HD2' ' A' ' 139' ' ' PRO . 49.8 p90 -72.86 -31.71 1.58 Allowed Pre-proline 0 CA--C 1.546 0.817 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 138' ' ' TYR . 97.0 Cg_endo -76.5 164.65 30.3 Favored 'Trans proline' 0 C--N 1.366 1.471 0 C-N-CA 121.248 1.298 . . . . 0.0 111.814 176.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 107.23 90.65 2.16 Favored Glycine 0 C--N 1.329 0.16 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.57 177.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.438 ' NZ ' ' HB2' ' A' ' 141' ' ' LYS . 4.5 ttmp? . . . . . 0 C--O 1.235 0.336 0 CA-C-O 120.697 0.284 . . . . 0.0 110.31 175.913 . . . . . . . . 1 1 . 1 stop_ save_